Exhibit 10.39 AMENDMENT NO. 2 TO DISTRIBUTORSHIP AGREEMENT --------------------------------------------
Exhibit 10.39
AMENDMENT NO. 2 TO DISTRIBUTORSHIP AGREEMENT
--------------------------------------------
This Amendment No. 2 to Distributorship Agreement ("Amendment No. 2") is
made this 30 day of September, 1996, by and between Molecular Simulations Inc.
("MSI"), ▇▇▇▇ ▇▇▇▇▇▇▇▇ ▇▇▇▇, ▇▇▇ ▇▇▇▇▇, ▇▇ ▇▇▇▇▇, and Teijin Molecular
Simulations Inc. ("TMSI"), ▇-▇, ▇▇▇▇▇▇▇▇▇▇-▇▇▇ ▇-▇▇▇▇▇, ▇▇▇▇▇▇▇-▇▇, ▇▇▇▇▇ ▇▇▇,
▇▇▇▇▇.
RECITALS
--------
A. MSI (formerly Polygen Corporation) and TMSI have entered into a
Distributorship Agreement dated April 1, 1992, as amended on October 17, 1994
(the "Agreement"). The October 17, 1994 amendment to the Agreement extended
TMSI's exclusive distribution territory under the Agreement to the following
countries (the "Asia Pacific" countries): South Korea, Taiwan, Hong Kong,
China, India, Singapore, Malaysia, Australia and New Zealand.
B. On August 15, 1995, MSI and Biosym Technologies, Inc. ("Biosym")
consummated a merger pursuant to which Biosym became a wholly-owned subsidiary
of MSI.
C. TMSI wishes to obtain the exclusive right to distribute the Biosym
software in the extended "Territory" as defined in the Agreement.
D. The parties desire to amend the terms and conditions of the Agreement,
as described in this Amendment No. 2.
NOW, THEREFORE, the parties agree as follows:
1. DEFINITIONS. The definition of "Software" in Section 1(f) of the
-----------
Agreement is amended to expressly include all computational chemistry software
products marketed by Biosym. This means that TMSI has exclusive rights under
the Agreement to distribute the Biosym products in the Asia Pacific countries.
2. APPENDIX A. Appendix A to the Agreement is hereby amended and
---------- ----------
replaced by the Appendix A attached to this Amendment No. 2.
----------
3. PAYMENTS. In consideration of the rights granted to TMSI under this
--------
Amendment No. 2, TMSI agrees to pay MSI the sum of [*] by wire transfer to the
bank account designated by MSI within thirty (30) days after execution of this
Agreement.
4. OTHER CHANGES. References in the Agreement to "Polygen Corporation,"
- -------------
"Polygen Molecular Simulations Inc." and "PMSI" shall be amended to refer to
"Molecular Simulations Incorporated" or "MSI," as the case may be. In Section
12(f) of the Agreement,
* CONFIDENTIAL TREATMENT REQUESTED
1
the governing law shall be changed from the "State of Massachusetts" to the
"State of California." The address of MSI for purposes of the Agreement shall be
changed to be the address first set forth above in this Agreement.
5. GENERAL. Upon execution of this Amendment No. 2 by both parties, this
-------
Amendment will become effective retroactive to April 1, 1996. Notwithstanding
this Amendment No. 2 and its retroactive effective date, TMSI acknowledges that
MSI has or will enter into an agreement directly with Teijin Limited on or about
the same date as this Amendment No. 2 under which Teijin will obtain the right
from MSI to participate in MSI's existing consortia and extensions thereof.
Except as amended hereby, the Agreement shall remain in full force and effect.
This Amendment No. 2 shall be governed by and construed under the laws of the
State of California, U.S.A., excluding its conflict of laws principles. This
Amendment No. 2 may be executed in counterparts, each of which shall be deemed
an original of this Amendment No. 2. Capitalized terms used but not defined
herein shall have the meanings ascribed to them in the Agreement.
IN WITNESS WHEREOF, the parties have caused this Amendment to be executed on the
date first written above.
MOLECULAR SIMULATIONS INC. TEIJIN MOLECULAR SIMULATIONS INC.
By: /s/ ▇▇▇▇▇ ▇▇▇▇▇ By: /s/ ▇▇▇▇▇ ▇. ▇▇▇▇▇▇▇▇▇▇▇
------------------------------- -------------------------------
Name: ▇▇▇▇▇ ▇▇▇▇▇ Name: ▇▇▇▇▇ ▇. ▇▇▇▇▇▇▇▇▇▇▇
----------------------------- ------------------------------
Title: Chief Financial Officer Title: President/CEO
----------------------------- -----------------------------
By: /s/ ▇▇▇▇▇▇▇ ▇▇▇▇▇
-------------------------------
Name: ▇▇▇▇▇▇▇ ▇▇▇▇▇
------------------------------
Title: Senior Vice President
-----------------------------
2
APPENDIX A
----------
MSI LIST PRICES FOR END USERS IN JAPAN AND ASIA PACIFIC COUNTRIES
-----------------------------------------------------------------
[NEW MSI PRICE LIST WITH LIST PRICES FOR JAPAN AND ASIA PACIFIC
TO BE ATTACHED]
3
SOFTWARE DESCRIPTION COMMERCIAL GOVERNMENT ACADEMIC
--------------------- ---------- ---------- --------
Affinity Affinity: Flexibly and automatically docks potential ligands (YEN)1540000 (YEN)770000 (YEN)231000
affinity into an active site. Requires Insight II and Discover. $10,000 $5,000 $1,500
Affinity User Guide Affinity User Guide (YEN)6930 (YEN)6930 (YEN)6930
docaffinity $45 $45 $45
Amorphous Cell Amorphous Cell: Construction and Analysis tools for (YEN)3080000 (YEN)1540000 (YEN)462000
amorphcell amorphous bulk polymers and interfacial phenomena. $20,000 $10,000 $3,000
Requires Insight II.
Apex-3D Apex-3D: Requires Insight II. (YEN)6160000 (YEN)3080000 (YEN)924000
apex3d $40,000 $20,000 $6,000
Apex-3D User Guide Apex-3D User Guide (YEN)7700 (YEN)7700 (YEN)7700
docapex3d $50 $50 $50
AXXESS (1 user) Axxess: X-terminal access to Insight II. Prices are per (YEN)847000 (YEN)423500 (YEN)127050
axxess01 license. Requires Insight II to be licensed on the host $5,500 $2,750 $825
workstation. Annual license.
AXXESS (2-5 user) Axxess: X-terminal access to Insight II. Prices are per (YEN)635250 (YEN)317702 (YEN)95326
axxess02 license. Requires Insight II to be licensed on the host $4,125 $2,063 $619
workstation. Annual license.
AXXESS (6+ user) Axxess: X-terminal access to Insight II. Prices are per (YEN)531300 (YEN)265650 (YEN)79772
axxess06 license. Requires Insight II to be licensed on the host $3,450 $1,725 $518
workstation. Annual license.
Biopolymer Biopolymer: Requires Insight II. (YEN)1925000 (YEN)962500 (YEN)288750
biopolymer $12,500 $6,250 $1,875
Brookhaven Protein Brookhaven Protein Databank: Database of protein crystal (YEN)154000 (YEN)154000 (YEN)154000
bnlpdb01 and NMR structures from BNL. One copy. Annual license. $1,000 $1,000 $1,000
Brookhaven Protein Brookhaven Protein Databank: Database of protein crystal (YEN)277200 (YEN)277200 (YEN)277200
bnlpdb02 and NMR structures from BNL. Two updates. Annual $1,800 $1,800 $1,800
license.
Brookhaven Protein Brookhaven Protein Databank: Database of protein crystal (YEN)523600 (YEN)523600 (YEN)523600
bnlpdb04 and NMR structures from BNL. Four updates. Annual $3,400 $3,400 $3,400
license.
C2 1.5 New C2 1.5 New Features Supplement (YEN)11550 (YEN)11550 (YEN)11550
docc215new $75 $75 $75
C2 1.6 New C2 1.6 New Features Supplement (YEN)11550 (YEN)11550 (YEN)11550
docc216new $75 $75 $75
C2.ADF C2.ADF: Amsterdam Density Functional code. (YEN)3465000 (YEN)1732500 (YEN)519750
c2adf Executable only. Floating license. $22,500 $11,250 $3,375
C2.ADF Interface C2.ADF Interface: Provides an interface to the Amsterdam (YEN)1155000 (YEN)577500 (YEN)173250
c2adfint Density Functional program. User interface only. Floating $7,500 $3,750 $1,125
license.
C2.Alignment C2.Alignment: Molecular similarity and superpositioning (YEN)770000 (YEN)385000 (YEN)115500
c2alignment methods. Floating license. $5,000 $2,500 $750
C2.Amorphous C2.Amorphous Builder: Builds models of amorphous (YEN)770000 (YEN)385000 (YEN)115500
c2amorphbldr polymers and polymer/solvent systems. Floating license. $5,000 $2,500 $750
C2.Analog Builder C2.Analog Builder: Builds a congeneric collection/library of (YEN)770000 (YEN)385000 (YEN)115500
c2analogbldr chemical structures. Floating license. $5,000 $2,500 $750
C2.Blends C2.Blends: Predicts phase behavior and phase diagrams. (YEN)2310000 (YEN)1155000 (YEN)346500
c2blends Requires ▇▇.▇▇▇. Floating license. $15,000 $7,500 $2,250
C2 Builders User C2 Builders User Reference (YEN)11550 (YEN)11550 (YEN)11550
docc2builder $75 $75 $75
MSI Price List (10/96) expressed in Japanese Yen for sales in Japan Molecular Simulations Inc.
SOFTWARE DESCRIPTION COMMERCIAL GOVERNMENT ACADEMIC
--------------------- ---------- ---------- --------
C2.CASTEP C2.CASTEP: A quantum mechanics code for materials (YEN)6545000 (YEN)3272500 (YEN)981750
c2castep science, the solid state, and surfaces. Executable only. $42,500 $21,250 $6,375
Floating license.
C2.CASTEP C2.CASTEP Interface: Provides an interface to the CASTEP (YEN)1155000 (YEN)577500 (YEN)173250
c2castepint program. Requires C2.Crystal Builder. User interface only. $7,500 $3,750 $1,125
Floating license.
C2.Conformers C2.Conformers: Provides conformational search algorithms (YEN)1155000 (YEN)577500 (YEN)173250
c2conformers and analysis tools for molecular structures. Requires $7,500 $3,750 $1,125
▇▇.▇▇▇. ▇▇.▇▇▇▇ recommended for Life Science
applications. Floating license.
C2.Crystal Builder C2.Crystal Builder: 3-D periodic crystal structure (YEN)770000 (YEN)385000 (YEN)115500
c2crystalbldr construction and display. Floating license. $5,000 $2,500 $750
C2.▇▇▇▇▇▇▇ ▇▇▇▇▇▇ C2.▇▇▇▇▇▇▇ ▇▇▇▇▇▇: Minimizes the energy of molecular (YEN)770000 (YEN)385000 (YEN)115500
c2crystalpckr crystals under full symmetry conditions. Requires $5,000 $2,500 $750
C2.Crystal Builder. Floating license.
C2.DB Access C2.DB Access: Provides access to Catalyst and MDL ISIS (YEN)770000 (YEN)385000 (YEN)115500
c2dbaccess database searching programs. Requires Catalyst/Info or $5,000 $2,500 $750
MDL ISIS. Floating license.
C2.Descriptor+ C2.Descriptor+: Materials Science QSAR descriptors. (YEN)770000 (YEN)385000 (YEN)115500
c2descriptor Requires C2oQSAR+. C2.Genetic Algorithms and $5,000 $2,500 $750
C2.Analog Builder recommended. Floating license.
C2.Descriptor+ C2.Descriptor+: Materials Science QSAR descriptors. (YEN)770000 (YEN)385000 (YEN)115500
c2desc1 Requires C2.QSAR+. C2.Genetic Algorithms and $5,000 $2,500 $750
C2.Analog Builder recommended. Floating license.
C2 Diffraction and C2 Diffraction and Microscopy User's Reference (YEN)11550 (YEN)11550 (YEN)11550
docc2diffmicro $75 $75 $75
C2.Diffraction-Amor C2.Diffraction-Amorphous: Simulates non-crystalline (YEN)1540000 (YEN)770000 (YEN)231000
c2diffamorph powder and fiber diffraction patterns and radial distribution $10,000 $5,000 $1,500
functions. Floating license.
C2.Diffraction-Cryst C2.Diffraction-Crystal: Simulates powder, fiber and single (YEN)1540000 (YEN)770000 (YEN)231000
c2diffcrystal crystal diffraction patterns. Requires C2.Crystal Builder. $10,000 $5,000 $1,500
Floating license.
C2.Diffraction-Fault C2.Diffraction-Faulted: Simulates powder diffraction from (YEN)1155000 (YEN)577500 (YEN)173250
c2difffault faulted or layered structures. Requires C2.Crystal Builder. $7,500 $3,750 $1,125
Floating license.
C2.Diversity C2.Diversity: Provides diversity/similarity selection (YEN)5390000 (YEN)2695000 (YEN)808500
c2diversity techniques and topological/information descriptors for the $35,000 $17,500 $5,250
characterization of same. Requires C2.QSAR+. Floating
license.
C2.DLS C2.DLS: Predicts structures of inorganic framework crystals (YEN)1155000 (YEN)577500 (YEN)173250
c2dls using geometric refinement. Requires C2.Crystal Builder. $7,500 $3,750 $1,125
Floating license.
C2.Dynamics C2.Dynamics: Performs molecular dynamics simulations and (YEN)2310000 (YEN)1155000 (YEN)346500
c2dynamics analysis. Requires ▇▇.▇▇▇. Floating license. $15,000 $7,500 $2,250
C2.EXAFS C2.EXAFS: Simulates, analyzes and refines EXAFS data. (YEN)3080000 (YEN)1540000 (YEN)462000
c2exafs Includes EXCURVE code. Floating license. $20,000 $10,000 $3,000
C2.Force Field C2.Force Field Editor: Provides force field customization (YEN)770000 (YEN)385000 (YEN)115500
c2ffeditor tools. Requires ▇▇.▇▇▇. Floating license. $5,000 $2,500 $750
C2.Gaussian C2.Gaussian Interface: Provides an interface to the (YEN)1155000 (YEN)577500 (YEN)173250
c2gaussian non-empirical Gaussian program. User interface only. $7,500 $3,750 $1,125
Floating license.
MSI Price List (10/96) expressed in Japanese Yen for sales in Japan Molecular Simulations Inc.
SOFTWARE DESCRIPTION COMMERCIAL GOVERNMENT ACADEMIC
-------------------- ---------- ---------- --------
C2.Genetic C2.Genetic Algorithims: Genetic function approximation (YEN)770000 (YEN)385000 (YEN)115500
c2geneticalgo applied to QSAR. Floating license. $5,000 $2,500 $750
C2.HRTEM C2.HRTEM: Simulates HRTEM images and dynamical (YEN)2310000 (YEN)1155000 (YEN)346500
c2hrtem diffraction patterns in crystals, interfaces and defects. $15,000 $7,500 $2,250
Requires C2.Crystal Builder. Floating license.
C2 Hypothesis and C2 Hypothesis and Receptor Models User's Reference (YEN)11550 (YEN)11550 (YEN)11550
docc2hyporec $75 $75 $75
C2 Installation and C2 Installation and Administration Guide (YEN)7700 (YEN)7700 (YEN)7700
docc2install $50 $50 $50
C2.Interface Builder C2.Interface Builder: Definition and display of interfaces between (YEN)385000 (YEN)192500 (YEN)57750
c2interfacebldr crystal structures. Requires C2.Crystal Builder. $2,500 $1,250 $375
Floating license.
C2.LEED/RHEED C2.LEED/RHEED: Simulates kinematic Low Energy and (YEN)1155000 (YEN)577500 (YEN)173250
c2leedrheed Reflection High Energy Electron Diffraction patterns. $7,500 $3,750 $1,125
Requires C2.Surface Builder. Floating license.
C2 Material Science C2 Material Science Tutorial Guide (YEN)11550 (YEN)11550 (YEN)11550
docc2matsci $75 $75 $75
C2.Mechanical C2.Mechanical Properties: Predicts the mechanical behavior (YEN)1540000 (YEN)770000 (YEN)231000
c2mechprops of bulk materials. Requires C2.Crystal Builder, ▇▇.▇▇▇, $10,000 $5,000 $1,500
C2.Minimizer, C2.Dynamics. Floating license.
C2.MFA C2.MFA: Molecular field analysis for 3D QSAR. Requires (YEN)3080000 (YEN)1540000 (YEN)462000
c2mfa ▇▇.▇▇▇, ▇▇.▇▇▇▇+, C2.FFEditor. Floating license. $20,000 $10,000 $3,000
C2.Minimizer C2.Minimizer: Performs energy minimization of molecular and (YEN)1540000 (YEN)770000 (YEN)231000
c2minimizer periodic structures. Requires ▇▇.▇▇▇. Floating license. $10,000 $5,000 $1,500
C2.MMFF C2.MMFF: Provides Merck Molecular Modeling Force Field for (YEN)1540000 (YEN)770000 (YEN)231000
c2mmff use with Drug Discovery applications. Requires ▇▇.▇▇▇. $10,000 $5,000 $1,500
Floating license.
C2 Modeling C2 Modeling Environment User's Reference (YEN)11550 (YEN)11550 (YEN)11550
docc2modenv $75 $75 $75
C2.MOPAC C2.MOPAC Interface: Provides an interface to the (YEN)770000 (YEN)385000 (YEN)115500
c2mopac semi-empirical MOPAC program. Includes MOPAC 6.0. $5,000 $2,500 $750
Floating license.
C2.Morphology C2.Morphology: Predicts and analyzes crystal morphology (YEN)2310000 (YEN)1155000 (YEN)346500
c2morphology from internal crystal structure. Requires C2.Crystal Builder, $15,000 $7,500 $2,250
▇▇.▇▇▇. Floating license.
▇▇.▇▇▇▇ Force Field ▇▇.▇▇▇▇ Force Field: Open force field includes library of (YEN)1540000 (YEN)770000 (YEN)231000
c2off standard materials force fields. Includes Dreiding, Universal, $10,000 $5,000 $1,500
and other force fields. Floating license.
C2.Polymer Builder C2.Polymer Builder: Construction of polymer chains. (YEN)770000 (YEN)385000 (YEN)115500
c2polymerbldr Includes monomer libraries. Floating license. $5,000 $2,500 $750
C2.Polymer C2.Polymer Properties: Calculates polymer physical (YEN)1540000 (YEN)770000 (YEN)231000
c2polyprops properties and structure. Floating license. $10,000 $5,000 $1,500
C2.Polymorph C2.Polymorph: Predicts polymorphs of organic molecules. YEN)11550000 (YEN)11550000 (YEN)11550000
c2polymorph Requires C2.Crystal Builder, ▇▇.▇▇▇. Floating license. $75,000 $75,000 $75,000
C2.Powder Indexing C2.Powder Indexing: Allows powder diffraction patterns to be (YEN)770000 (YEN)385000 (YEN)115500
c2powderindx indexed. Includes TREOR code. Floating license. $5,000 $2,500 $750
C2 Property C2 Property Prediction User's Reference (YEN)11550 (YEN)11550 (YEN)11550
docc2proppred $75 $75 $75
MSI Price List (10/96) expressed in Japanese Yen for sales in Japan
Molecular Simulations Inc.
SOFTWARE DESCRIPTION COMMERCIAL GOVERNMENT ACADEMIC
--------------------- ---------- ---------- --------
C2.QSAR+ C2.QSAR+: Comprehensive toolkit for 2D and 3D QSAR. (YEN)3080000 (YEN)1540000 (YEN)462000
c2qsar Floating license. $20,000 $10,000 $3,000
C2 QSAR+ User's C2 QSAR+ User's Reference (YEN)11550 (YEN)11550 (YEN)11550
docc2qsar $75 $75 $75
C2 Quantum C2 Quantum Mechanics Workbench User's Reference (YEN)11550 (YEN)11550 (YEN)11550
docc2qmw $75 $75 $75
C2.Receptor C2.Receptor: Toolkit for creation and evaluation of (YEN)1540000 (YEN)770000 (YEN)231000
c2receptor pseudo-receptor models. Floating license. $10,000 $5,000 $1,500
C2.Rietveld C2.Rietveld: Performs crystal structure refinement and (YEN)2310000 (YEN)1155000 (YEN)346500
c2rietveld quantitative phase analysis using DBWS or GSAS. Requires $15,000 $7,500 $2,250
C2.Crystal Builder. Includes DBWS code. Floating license.
C2 SDK C2 SDK Programmer's Guide (YEN)11550 (YEN)11550 (YEN)11550
docc2sdkprog $75 $75 $75
C2.SDK-3rd party C2.SDK: Refer all third party opportunities directly to New (YEN)0 (YEN)0 (YEN)0
c2sdk3rdparty Business Development (▇▇▇▇ ▇▇▇▇▇ Santi). N/A N/A N/A
C2.SDK-internal first C2.SDK: Software Developers Kit. Requires C2.Visualizer. (YEN)0 (YEN)0 (YEN)1232000
c2sdkfacds Multi-user SDK license for an academic research group. N/A N/A $8,000
Includes full support for one designated user.
C2.SDK-internal first C2.SDK: Software Developers Kit. Requires C2.Visualizer. (YEN)0 (YEN)0 (YEN)770000
c2sdkfac Multi-user SDK license for an academic research group. N/A N/A $5,000
Support not included.
C2.SDK-internal first C2.SDK: Software Developers Kit. Requires C2.Visualizer. (YEN)0 (YEN)0 (YEN)462000
c2sdkres Single-user SDK license for an academic research group. N/A N/A $3,000
Support not included. Additional licenses priced at $500
each.
C2.SDK-internal C2.SDK: Software Developers Kit. Requires C2.Visualizer. (YEN)462000 (YEN)462000 (YEN)0
c2sdkintadd Support limited to two named users at site (one for academic); $3,000 $3,000 N/A
training not included in price. Price per additional license.
C2.SDK-internal first C2.SDK: Software Developers Kit. Requires C2.Visualizer. (YEN)6160000 (YEN)6160000 (YEN)0
c2sdkintfirst Support limited to two named users at site (one for academic); $40,000 $40,000 N/A
training not included in price.
C2 Simulation Tools C2 Simulation Tools User's Reference (YEN)11550 (YEN)11550 (YEN)11550
docc2simtool $75 $75 $75
C2.Sorption C2.Sorption: Predicts adsorption properties of microporous (YEN)2310000 (YEN)1155000 (YEN)346500
c2sorption materials. Requires C2.Crystal Builder, ▇▇.▇▇▇. Floating $15,000 $7,500 $2,250
license.
C2.Super ADF C2.Super ADF: Amsterdam Density Functional code for (YEN)10395000 (YEN)5197500 (YEN)1559250
c2superadf supercomputers. Executable only. Host-locked license. $67,500 $33,750 $10,125
C2.Super CASTEP C2.Super CASTEP: A quantum mechanics code for materials (YEN)19635000 (YEN)9817500 (YEN)2945250
c2supercastep science, the solid state, and surfaces. Executable only. $127,500 $63,750 $19,125
Host-locked license.
C2.Surface Builder C2.Surface Builder: Surface chemistry 2-D periodic model (YEN)385000 (YEN)192500 (YEN)57750
c2surfacebldr builder. Requires C2.Crystal Builder. Floating license. $2,500 $1,250 $375
C2 Using Command C2 Using Command Scripts (YEN)7700 (YEN)7700 (YEN)7700
docc2command $50 $50 $50
C2.Visualizer C2.Visualizer: Comprehensive chemical computing (YEN)770000 (YEN)770000 (YEN)115500
c2visualizer environment. Required core product. Floating license. $5,000 $5,000 $750
MSI Price List (10/96) expressed in Japanese Yen for sales in Japan Molecular Simulations Inc.
SOFTWARE DESCRIPTION COMMERCIAL GOVERNMENT ACADEMIC
--------------------- ---------- ---------- --------
C2.X-GEN C2.X-GEN: Integrated package for the processing and (YEN)2310000 (YEN)1155000 (YEN)346500
c2xgen reduction of diffraction data from area detectors. Requires $15,000 $7,500 $2,250
C2.Visualizer. Floating license.
Catalysis User Catalysis User Guide (YEN)7700 (YEN)7700 (YEN)7700
doccatalysis $50 $50 $50
Catalysis and Catalysis/Sorption Consortium: Customers must purchase YEN)32340000 (YEN)0 (YEN)0
conscatsorp licenses for Insight II, Discover, Solids Builder, Sorption, $210,000 N/A N/A
Solids Docking, and Reaction Patterns for
$60,000. Members receive 3 copies of all
software developed during Phase II.
Catalyst Installation Guide and Release Notes (YEN)3850 (YEN)3850 (YEN)3850
doccatinstall $25 $25 $25
Catalyst Tutorials (YEN)6930 (YEN)6930 (YEN)6930
doccattutorial $45 $45 $45
Catalyst/ACD Catalyst/ACD: Available Chemicals Directory. Requires (YEN)1540000 (YEN)1540000 (YEN)1540000
catacd01 Catalyst/Info. Annual License. $10,000 $10,000 $10,000
Catalyst/ACD (2-10 Catalyst/ACD: Available Chemicals Directory. Requires (YEN)2926000 (YEN)2926000 (YEN)2926000
catacd02 Catalyst/Info. Annual License. $19,000 $19,000 $19,000
Catalyst/ACD Catalyst/ACD: Available Chemicals Directory. Requires (YEN)3850000 (YEN)3850000 (YEN)3850000
catacd11 Catalyst/Info. Annual License. $25,000 $25,000 $25,000
Catalyst/BioByte Catalyst/BioByte Master File: 25,000 small molecules, (YEN)1078000 (YEN)1078000 (YEN)1078000
catbiobyte Pomona College Medicinal Chemistry. Requires $7,000 $7,000 $7,000
Catalyst/Info. Annual license.
Catalyst/View Catalyst/Compare: Provides query-query, (YEN)3388000 (YEN)1694000 (YEN)508200
catcompare compound-compound, and query-compound comparision and $22,000 $11,000 $3,300
overaly functionality. Floating License.
Catalyst/DB Server Catalyst/DB Server: Database server for Catalyst. Requires (YEN)2156000 (YEN)1078000 (YEN)323400
catdbserver Catalyst/View. Floating license. $14,000 $7,000 $2,100
Catalyst/Derwent's Catalyst/Derwent: Catalog of 40,000 compounds and (YEN)4158000 (YEN)4158000 (YEN)4158000
carderwent11 descriptive data. Requires Catalyst/Info. Annual license. $27,000 $27,000 $27,000
Catalyst/Derwent Catalyst/Derwent: Catalog of 40,000 compounds and (YEN)2310000 (YEN)2310000 (YEN)2310000
catderwent01 descriptive data. Requires Catalyst/Info. Annual license. $15,000 $15,000 $15,000
Catalyst/Derwent's Catalyst/Derwent: Catalog of 40,000 compounds and (YEN)3465000 (YEN)3465000 (YEN)3465000
catderwent02 descriptive data. Requires Catalyst/Info. Annual license. $22,500 $22,500 $22,500
Catalyst/Hypo Catalyst/Hypo: Allows additional simultaneous batch (YEN)6468000 (YEN)3234000 (YEN)970200
cathypo hypothesis generation. Requires Catalyst/View. Floating $42,000 $21,000 $6,300
license.
Catalyst/Info Catalyst/Info: Integrated 1D, 2D, 3D chemical database (YEN)4312000 (YEN)2156000 (YEN)646800
catinfo system. Requires Catalyst/View. Floating license. $28,000 $14,000 $4,200
Catalyst/Maybridge Catalyst/Maybridge: Catalog of 47,000 compounds. Included (YEN)0 (YEN)0 (YEN)0
catmaybridge with Catalyst/Info. Annual license. No Charge No Charge No Charge
Catalyst/NCI Catalyst/NCI: National Cancer Institute database with 98,000 (YEN)0 (YEN)0 (YEN)0
catnci registered compounds. Included with Catalyst/Info. Annual No Charge No Charge No Charge
license.
Catalyst/Shape Catalyst/Shape: Performs multiconformation shape similarity (YEN)2772000 (YEN)2772000 (YEN)415800
catshape searching. Calculates 3D shape descriptors for the $18,000 $18,000 $2,700
characterization of combinatorial libraries. Requires
Catalyst/View and Catalyst/DB Server. Catalyst/Info
recommended. Floating license.
MSI Price List (10/96) expressed in Japanese Yen for sales in Japan Molecular Simulations Inc.
SOFTWARE DESCRIPTION COMMERCIAL GOVERNMENT ACADEMIC
--------------------- ---------- ---------- --------
Catalyst/View Catalyst/View: Drug discovery environment for identifying (YEN)4158000 (YEN)4158000 (YEN)623700
catview active, structurally diverse leads for both the medicinal $27,000 $27,000 $4,050
chemist and modeler. Floating license.
Catalyst/View Catalyst/Visualizer: Drug discover environment for (YEN)770000 (YEN)770000 (YEN)115500
catvisualizer identifying active, structurally diverse leads for both the $5,000 $5,000 $750
medicinal chemist and modeler. Floating license.
CFF 95 CFF 95: Requires Discover. (YEN)2310000 (YEN)1155000 (YEN)346500
cff95 $15,000 $7,500 $2,250
Characterize Characterize: Base Module requirement for most analytical (YEN)462000 (YEN)231000 (YEN)69300
characterize simulations in InsightII. Includes geometric analysis tools. $3,000 $1,500 $450
Part of Catalysis Consortium. Requires Insight II.
CHARMm Command CHARMm Command Dictionary Part One and Two (YEN)5390 (YEN)5390 (YEN)5390
doccharmmdict $35 $35 $35
CHARMm CHARMm: Comprehensive force field and program for energy (YEN)6006000 (YEN)3003000 (YEN)900900
charmm calculations. Includes extensive parameter library. $39,000 $19,500 $5,850
Host-locked license.
CHARMm Principles CHARMm Principles (YEN)7700 (YEN)7700 (YEN)7700
doccharmmprin $50 $50 $50
CHARMm/MMFF CHARMm/MMFF: Merck Molecular force field option to (YEN)1540000 (YEN)770000 (YEN)231000
charmmmmff CHARMm. Includes extensive parameter library. Requires $10,000 $5,000 $1,500
QUANTA, CHARMm. Host-locked license.
CombiChem (1996 CombiChem Consortium: Customers must also purchase YEN)13090000 (YEN)0 (YEN)0
conscombi licenses for C2 Drug Discovery software. Members receive $85,000 N/A N/A
software licenses per agreement.
ConFirm ConFirm: Conformational model generator using ▇▇▇▇▇▇ to (YEN)3080000 (YEN)1540000 (YEN)462000
confirm promote coverage. Floating license. $20,000 $10,000 $3,000
ConFirm User's ConFirm User's Guide (YEN)7700 (YEN)7700 (YEN)7700
docconfirm $50 $50 $50
Consensus Consensus: Requires Insight II and Homology. (YEN)2772000 (YEN)1386000 (YEN)415800
consensus $18,000 $9,000 $2,700
Consensus User Consensus User Guide (YEN)6930 (YEN)6930 (YEN)6930
docconsensus $45 $45 $45
Consulting (daily) (YEN)277200 (YEN)277200 (YEN)277200
consulting $1,800 $1,800 $1,800
Converter Converter: Requires Insight II and Sketcher. (YEN)3850000 (YEN)1925000 (YEN)577500
converter $25,000 $12,500 $3,750
Converter User Converter User Guide (YEN)4620 (YEN)4620 (YEN)4620
docconverter $30 $30 $30
Crystal Cell Crystal Cell: Study Energetics of Crystalline polymer (YEN)1540000 (YEN)770000 (YEN)231000
crystalcell systems. Requires Insight II. $10,000 $5,000 $1,500
DeCipher DeCipher: Requires Insight II, Analysis, and Discover. (YEN)1540000 (YEN)770000 (YEN)231000
decipher $10,000 $5,000 $1,500
DeCipher User DeCipher User Guide (YEN)5390 (YEN)5390 (YEN)5390
docdecipher $35 $35 $35
DelPhi and DelPhi and Solvation User Guide (YEN)7700 (YEN)7700 (YEN)7700
docdelphi $50 $50 $50
DelPhi DelPhi: Requires Insight II. (YEN)5544000 (YEN)2772000 (YEN)831600
delphi $36,000 $18,000 $5,400
MSI Price List (10/96) expressed in Japanese Yen for sales in Japan Molecular Simulations Inc.
SOFTWARE DESCRIPTION COMMERCIAL GOVERNMENT ACADEMIC
--------------------- ---------- ---------- --------
Diffraction Diffraction: X-ray and Electron single crystal and powder (YEN)1540000 (YEN)770000 (YEN)231000
diffraction Diffaction, Crystalline, Amorphous and Fiber diffraction. $10,000 $5,000 $1,500
Requires Insight II and Characterize.
DISCON/NOESYSI DISCON/NOESYSIM: Software for generating restraints (YEN)962500 (YEN)481250 (YEN)144452
discon using relaxation matrix analysis. Requires NMR Structure $6,250 $3,125 $938
Determination. Host-locked license.
Discover (3 parts) Discover (3 parts) (YEN)11550 (YEN)11550 (YEN)11550
docdiscover $75 $75 $75
Discover Discover: A molecular mechanics simulation environment (YEN)6006000 (YEN)3003000 (YEN)900900
discover offering energy minimization, dynamics and Monte Carlo $39,000 $19,500 $5,850
techniques. Requires Insight II.
Dmol Dmol: Local Density Functional quantum mechanics code. (YEN)4620000 (YEN)2310000 (YEN)693000
dmol molecular systems only. Symmetry supported. $30,000 $15,000 $4,500
InsightII Recommended
DMol User Guide DMol User Guide (YEN)7700 (YEN)7700 (YEN)7700
docdmol $50 $50 $50
DSolid DSolid: Requires Insight II. (YEN)7700000 (YEN)3850000 (YEN)1155000
dsolid $50,000 $25,000 $7,500
EOM (1996 fee; EOM Consortium: Customers must also purchase licenses YEN)21560000 (YEN)0 (YEN)0
conseom for Insight II, Discover, and Solids Builder for $40,000 and at $140,000 N/A N/A
least one EOM code product for $45,000.
Members receive 3 copies of all software
developed during Phase II.
EOM-DSolid EOM-DSolid (YEN)7700 (YEN)7700 (YEN)7700
docdsolid $50 $50 $50
EOM-ESOCS EOM-ESOCS (YEN)6160 (YEN)6160 (YEN)6160
docesocs $40 $40 $40
EOM-Fast Stucture EOM-Fast Stucture (YEN)6160 (YEN)6160 (YEN)6160
docfaststr $40 $40 $40
EOM-Plane Wave EOM-Plane Wave (YEN)6160 (YEN)6160 (YEN)6160
docplanewave $40 $40 $40
ESOCS ESOCS: Requires Insight II. (YEN)7700000 (YEN)3850000 (YEN)1155000
esocs $50,000 $25,000 $7,500
EXAFS EXAFS: FEFF EXAFS scattering simulation. Requires Insight (YEN)770000 (YEN)385000 (YEN)115500
exafs II and Characterize. $5,000 $2,500 $750
FastStruct/SimAnn FastStruct/SimAnn: Requires Insight II. (YEN)7700000 (YEN)3850000 (YEN)1155000
faststruct $50,000 $25,000 $7,500
▇▇▇▇▇ for Windows ▇▇▇▇▇ for Windows: (YEN)231000 (YEN)231000 (YEN)154000
felixwin01 $1,500 $1,500 $1,000
▇▇▇▇▇ for Windows ▇▇▇▇▇ for Windows: (YEN)770000 (YEN)770000 (YEN)512050
felixwin05 $5,000 $5,000 $3,325
▇▇▇▇▇ for Windows ▇▇▇▇▇ for Windows: (YEN)1155000 (YEN)1155000 (YEN)770000
felixwin10 $7,500 $7,500 $5,000
▇▇▇▇▇ for Windows ▇▇▇▇▇ for Windows: (YEN)2310000 (YEN)2310000 (YEN)1540000
felixwin25 $15,000 $15,000 $10,000
▇▇▇▇▇ for Windows ▇▇▇▇▇ for Windows: Requires an existing license for ▇▇▇▇▇ (YEN)45430 (YEN)45430 (YEN)30030
felixwinupgr01 for Windows. $295 $295 $195
▇▇▇▇▇ for Windows ▇▇▇▇▇ for Windows: Requires an existing license for ▇▇▇▇▇ (YEN)154000 (YEN)154000 (YEN)96250
felixwinupgr10 for Windows. $1,000 $1,000 $625
MSI Price List (10/96) expressed in Japanese Yen for sales in Japan Molecular Simulations Inc.
SOFTWARE DESCRIPTION COMMERCIAL GOVERNMENT ACADEMIC
--------------------- ---------- ---------- --------
▇▇▇▇▇ User Guide, ▇▇▇▇▇ User Guide, Tutorial, and Reference Guide (YEN)11550 (YEN)11550 (YEN)11550
docfelix $75 $75 $75
▇▇▇▇▇-2D ▇▇▇▇▇-2D: (YEN)3080000 (YEN)1540000 (YEN)462000
felix2d $20,000 $10,000 $3,000
▇▇▇▇▇-Assign ▇▇▇▇▇-Assign: Requires ▇▇▇▇▇-2D or ▇▇▇▇▇-ND. (YEN)4620000 (YEN)2310000 (YEN)693000
felixassign $30,000 $15,000 $4,500
▇▇▇▇▇-Model ▇▇▇▇▇-Model: Requires ▇▇▇▇▇-2D or ▇▇▇▇▇-ND. (YEN)2310000 (YEN)1155000 (YEN)346500
felixmodel $15,000 $7,500 $2,250
▇▇▇▇▇-ND ▇▇▇▇▇-ND: (YEN)4620000 (YEN)2310000 (YEN)693000
felixnd $30,000 $15,000 $4,500
▇▇▇▇▇-X-Remote ▇▇▇▇▇-X-Remote: Requires any ▇▇▇▇▇. (YEN)770000 (YEN)385000 (YEN)115500
felixxremote $5,000 $2,500 $750
File Formats File Formats Reference (YEN)6160 (YEN)6160 (YEN)6160
docfileformats $40 $40 $40
Flexiblend Flexiblend: Requires Insight II and Discover. (YEN)1540000 (YEN)770000 (YEN)231000
flexiblend $10,000 $5,000 $1,500
HipHop HipHop: Feature-based alignment tool for 3D QSAR and 3D (YEN)3080000 (YEN)1540000 (YEN)462000
hiphop search queries. Floating license. $20,000 $10,000 $3,000
HipHop User's Guide HipHop User's Guide (YEN)7700 (YEN)7700 (YEN)7700
dochiphop $50 $50 $50
Homology Homology: Requires Insight II and Discover. (YEN)4620000 (YEN)2310000 (YEN)693000
homology $30,000 $15,000 $4,500
Homology User Homology User Guide (YEN)7700 (YEN)7700 (YEN)7700
dochomology $50 $50 $50
Insight (2 parts) Insight (2 parts) (YEN)7700 (YEN)7700 (YEN)7700
docinsight $50 $50 $50
Insight 300 Release Insight 300 Release Documentation (YEN)3080 (YEN)3080 (YEN)3080
docins300 $20 $20 $20
Insight 950 Release Insight 950 Release Documentation (YEN)3080 (YEN)3080 (YEN)3080
docins950 $20 $20 $20
Insight AXXESS Insight AXXESS User Guide (YEN)5390 (YEN)5390 (YEN)5390
docaxxess $35 $35 $35
Insight II 4.0.0 Release Documentation (YEN)3080 (YEN)3080 (YEN)3080
docins400 $20 $20 $20
Insight II 4.0.0 User's Guide (YEN)7700 (YEN)7700 (YEN)7700
docins400user $50 $50 $50
Insight II Insight II: General chemical modeling envioronment with (YEN)1925000 (YEN)962500 (YEN)288750
insight customizable macro interface. $12,500 $6,250 $1,875
Interphases Interphases: Calculate statistical properties of mono and (YEN)1540000 (YEN)770000 (YEN)231000
interphases bilayers in a polyemeric interphase system. Requires Insight $10,000 $5,000 $1,500
II.
IR_Raman IR_Raman: Simulation and display of Infra-Red vibrational (YEN)770000 (YEN)385000 (YEN)115500
irraman spectra and normal mode analysis. Requires Insight II and $5,000 $2,500 $750
Characterize.
License Guide License Guide (YEN)3850 (YEN)3850 (YEN)3850
doclicense $25 $25 $25
Ligand Design User Ligand Design User Guide (YEN)4620 (YEN)4620 (YEN)4620
docligand $30 $30 $30
MSI Price List (10/96) expressed in Japanese Yen for sales in Japan Molecular Simulations Inc.
SOFTWARE DESCRIPTION COMMERCIAL GOVERNMENT ACADEMIC
--------------------- ---------- ---------- --------
▇▇▇▇ ▇▇▇▇: Requires Insight II. (YEN)4620000 (YEN)2310000 (YEN)693000
ludi $30,000 $15,000 $4,500
Ludi/ACD Ludi/ACD: Requires Ludi. (YEN)1540000 (YEN)770000 (YEN)462000
ludiacd $10,000 $5,000 $3,000
MADSYS: Provides phasing for multiple anomalous (YEN)1540000 (YEN)770000 (YEN)231000
madsys dispersion data. Requires XSIGHT. $10,000 $5,000 $1,500
MCSS/Hook MCSS/HOOK: Receptor structure-based ligand design with (YEN)3465000 (YEN)1732500 (YEN)519750
mcsshook database search. Requires QUANTA, CHARMm. Host-locked $22,500 $11,250 $3,375
license.
MCSS/Hook User's MCSS/Hook User's Guide (YEN)7700 (YEN)7700 (YEN)7700
docmcsshook $50 $50 $50
Miscibility Miscibility: Requires Insight II, Phase Diagram, Flexiblend, (YEN)1540000 (YEN)770000 (YEN)231000
miscibility and ▇▇▇▇▇▇▇. $10,000 $5,000 $1,500
Modeler Modeler (for Insight II): Provides automated homology (YEN)3542000 (YEN)1771000 (YEN)531300
insmodeler modeling. Requires Insight II and Homology. Host-locked $23,000 $11,500 $3,450
license.
Modeler Modeler (for QUANTA): Provides automated homology (YEN)3542000 (YEN)1771000 (YEN)531300
modeler modeling. Requires QUANTA. Host-locked license. $23,000 $11,500 $3,450
Morphology Morphology: Predicts and analyzes crystal morphology from (YEN)770000 (YEN)385000 (YEN)115500
morphology internal crystal structure. Requires InsightII, Solids_Builder, $5,000 $2,500 $750
and Characterize.
Networks Networks: Monte Carlo technique for study network formation (YEN)1540000 (YEN)770000 (YEN)231000
networks and cross-linking. Requires Insight II. $10,000 $5,000 $1,500
NMR Compass NMR.Compass: Software for computer aided assignment and (YEN)3850000 (YEN)1925000 (YEN)577500
nmrcompass analysis of multidimensional data. QUANTA recommended. $25,000 $12,500 $3,750
Host-locked license.
NMR.Compass User NMR.Compass User Guide (YEN)11550 (YEN)11550 (YEN)11550
docnmrcompass $75 $75 $75
NMR Pipe NMR.Pipe: Software for multidimensional NMR spectral (YEN)4620000 (YEN)2310000 (YEN)693000
nmrpipe processing. Stand-alone executable only; no integration with $30,000 $15,000 $4,500
NMR.Compass. Host-locked license.
NMR.Pipe User's NMR.Pipe User's Guide (YEN)3850 (YEN)3850 (YEN)3850
docnmrpipe $25 $25 $25
NMR Refine NMR Refine Advance: Requires Insight II and Discover. (YEN)6160000 (YEN)3080000 (YEN)924000
nmrrefineadv $40,000 $20,000 $6,000
NMR Refine NMR Refine Complete: Includes NMR Refine Advance and (YEN)9240000 (YEN)4620000 (YEN)1386000
nmrrefinecom NMR Refine DG. Requires Insight II and Discover. $60,000 $30,000 $9,000
NMR Refine DGII NMR Refine DGII: Requires Insight II. (YEN)4620000 (YEN)2310000 (YEN)693000
nmrrefinedg $30,000 $15,000 $4,500
NMR Structure NMR Structure Determination: Software for structure (YEN)3542000 (YEN)1771000 (YEN)531300
nmrstructure generation and strucuture analysis/evaluation. Requires $23,000 $11,500 $3,450
QUANTA. Host-locked license.
NMRchitect User NMRchitect User Guide (YEN)7700 (YEN)7700 (YEN)7700
docnmrchitect $50 $50 $50
Open Interface Open Interface Programmer Guide (YEN)7700 (YEN)7700 (YEN)7700
docopenint $50 $50 $50
Open Interface Open Interface: Requires Insight II. Annual license pricing (YEN)770000 (YEN)770000 (YEN)115500
openint ($3333 license fee, $1667 maintenance fee). $5,000 $5,000 $750
MSI Price List (10/96) expressed in Japanese Yen for sales in Japan Molecular Simulations Inc.
SOFTWARE DESCRIPTION COMMERCIAL GOVERNMENT ACADEMIC
--------------------- ---------- ---------- --------
PEFC Associate PEFC Associate Membership: Non-voting membership. (YEN)770000 (YEN)385000 (YEN)115500
conspefcasso2 1 force field seat. No consortium software or databases. $5,000 $2,500 $750
No workshop attendance. Limited suppport. Not available for
new memberships. Price per year after first year.
PEFC Executive PEFC Executive Membership: Voting membership. 8 force (YEN)6930000 (YEN)3465000 (YEN)1039500
conspefcexec1 field seats. Site license for consortium software and $45,000 $22,500 $6,750
databases. Workshop attendance available at additional cost.
Support included. Price per year, 3 year commitment.
PEFC Executive PEFC Executive Membership: Voting membership. 8 force (YEN)3850000 (YEN)1925000 (YEN)577500
conspefcexec2 field seats. Site license for consortium software and $25,000 $12,500 $3,750
databases. Workshop attendance available at additional cost.
Support included. Price per year after first 3 years.
PEFC Standard PEFC Standard Membership: Non-voting membership. 3 force (YEN)3080000 (YEN)0 (YEN)0
conspefcstd field seats. 1 workstation license for consortium software and $20,000 N/A N/A
databases. Workshop attendance available at additional cost.
Support included. Price per year, 3 year commitment.
Phase Diagram Phase Diagram: Calculate liquid-liquid phase diagrams for (YEN)1540000 (YEN)770000 (YEN)231000
phasediagram polymer solutions and blends. Requires Insight II. $10,000 $5,000 $1,500
Plane Wave Plane Wave: Requires Insight II. (YEN)7700000 (YEN)3850000 (YEN)1155000
planewave $50,000 $25,000 $7,500
Polymer (3 parts) Polymer (3 parts) (YEN)15400 (YEN)15400 (YEN)15400
docpolymer $100 $100 $100
Polymer (1-year: Polymer Consortium: No products included in corsortium (YEN)13860000 (YEN)0 (YEN)0
conspolymer01 price. Customers advised to purchase licenses for Insight II, $90,000 N/A N/A
Discover, and a variety of Polymer modules.
Polymer (3-year: Polymer Consortium: No products included in corsortium (YEN)10780000 (YEN)0 (YEN)0
conspolymer03 price. Customers advised to purchase licenses for Insight II, $70,000 N/A N/A
Discover, and a variety of Polymer modules. Price is per year.
Polymerizer Polymerizer: Construction of polymer chains, Including (YEN)1155000 (YEN)577500 (YEN)173250
polymerizer monomer libraries. Requires InsightII. $7,500 $3,750 $1,125
PolyNMR PolyNMR: Predicts NMR spectra for polymer chains. (YEN)1540000 (YEN)770000 (YEN)231000
polynmr Requires Insight II and RIS. $10,000 $5,000 $1,500
PRISM PRISM: Predicts polymer blends miscibility based on (YEN)1540000 (YEN)770000 (YEN)231000
prism chemical composition. Requires Insight II. $10,000 $5,000 $1,500
Profiles 3D User Profiles 3D User Guide (YEN)6930 (YEN)6930 (YEN)6930
docprofiles3d $45 $45 $45
Profiles-3D Profiles-3D: Requires Insight II. (YEN)2695000 (YEN)1347500 (YEN)404250
profiles3d $17,500 $8,750 $2,625
Protein Health Protein Health: Provides identification of structural anomalies. (YEN)1540000 (YEN)770000 (YEN)231000
health Requires QUANTA. Host-locked license. $10,000 $5,000 $1,500
Protein Modeling Protein Modeling: System for homology and structural (YEN)4620000 (YEN)2310000 (YEN)693000
protein analysis of proteins. Requires QUANTA. Includes Protein $30,000 $15,000 $4,500
Design and Protein Health. Host-locked license.
QSPR QSPR: Quantitative Structure Property Relationships predicts (YEN)1540000 (YEN)770000 (YEN)231000
qspr properties for a wide range of thermoplastic materials. $10,000 $5,000 $1,500
Requires Insight II.
QUANTA 4.1 New QUANTA 4.1 New Features Supplement (YEN)7700 (YEN)7700 (YEN)7700
docq41new $50 $50 $50
MSI Price List (10/96) expressed in Japanese Yen for sales in Japan Molecular Simulations Inc.
SOFTWARE DESCRIPTION COMMERCIAL GOVERNMENT ACADEMIC
--------------------- ---------- ---------- --------
QUANTA Basic QUANTA Basic Operations (YEN)5390 (YEN)5390 (YEN)5390
docqbasicops $35 $35 $35
QUANTA core QUANTA core: Complete molecular modeling environment. (YEN)3080000 (YEN)1540000 (YEN)462000
quanta CHARMm strongly recommended. Host-locked license. $20,000 $10,000 $3,000
QUANTA QUANTA Generating and Displaying Molecules (YEN)5390 (YEN)5390 (YEN)5390
docqgendisp $35 $35 $35
QUANTA NMR QUANTA NMR Structure Determination User's Guide (YEN)5390 (YEN)5390 (YEN)5390
docqnmrstr $35 $35 $35
QUANTA Protein QUANTA Protein Homology Modeling Tutorial (YEN)5390 (YEN)5390 (YEN)5390
docqhomology $35 $35 $35
QUANTA Protein QUANTA Protein User's Reference (YEN)5390 (YEN)5390 (YEN)5390
docqprotein $35 $35 $35
QUANTA QUANTA Simulation, Search, and Analysis (YEN)5390 (YEN)5390 (YEN)5390
docqsimsearch $35 $35 $35
QUANTA96 New Features Supplement (YEN)7700 (YEN)7700 (YEN)7700
docq96new $50 $50 $50
QuanteMM QuanteMM (YEN)7700 (YEN)7700 (YEN)7700
docquantemm $50 $50 $50
QuanteMM QuanteMM: Hybrid QM/MM technique for optimizing large (YEN)2310000 (YEN)1155000 (YEN)346500
quantemm or periodic structures. Can use Mopac, Dmol or Turbomole as $15,000 $7,500 $2,250
QM engine. Requires Insight II and Discover
Reaction Patterns Reaction Patterns: Reaction engineering toolkit. (YEN)1540000 (YEN)770000 (YEN)231000
reactpatterns Complimentary tools for evaluation reaction trends. Requires $10,000 $5,000 $1,500
Insight II.
RIS RIS: Calculate conformational properties of polymer chains. (YEN)1540000 (YEN)770000 (YEN)231000
ris Requires Insight II. $10,000 $5,000 $1,500
Search/Compare Search/Compare: Requires Insight II. (YEN)3080000 (YEN)1540000 (YEN)462000
searchcomp $20,000 $10,000 $3,000
Search Compar Search Compar User Guide (YEN)7700 (YEN)7700 (YEN)7700
docsearchcomp $50 $50 $50
Sketcher Sketcher: 2-D sketcher with ▇▇▇▇ ▇▇▇▇▇▇▇▇-geometry 3D (YEN)385000 (YEN)192500 (YEN)57750
sketcher converter. $2,500 $1,250 $375
Solids Builder Solids Builder: Crystal Building 3-D periodic structures, 2-D (YEN)2310000 (YEN)1155000 (YEN)346500
solidsbldr Surfaces and Interfaces. Requires Insight II. Includes Solids $15,000 $7,500 $2,250
Adjustment.
Solids Diffusion: Studies the behavior of molecules iwthin (YEN)1540000 (YEN)770000 (YEN)231000
solidsdiffusion microporous host materials. Requires Insight II, Discover. $10,000 $5,000 $1,500
Solids Docking Solids Docking: Highly automated procedures for investigation (YEN)2310000 (YEN)1155000 (YEN)346500
solidsdocking of interactions of molecules with surfaces and porous $15,000 $7,500 $2,250
materials. Requires Insight II and Solids Builder and Discover.
Solids Simulation Solids Simulation: Lattice Minimization and Dynamics for (YEN)1540000 (YEN)770000 (YEN)231000
solidssimul Inorganic systems including Melt-Quench protocols for $10,000 $5,000 $1,500
creating silicate glasses. Requires Insight II.
Solids-NMR Solids-NMR: Predicts Si29 Solid State NMR pattern for (YEN)770000 (YEN)385000 (YEN)115500
solidsnmr Zeolites. Should rtecommend TurboNMR for higher degree of $5,000 $2,500 $750
accuracy. Requires Insight II and Characterize.
Sorption Sorption: Requires Insight II, Solids Builder. (YEN)2310000 (YEN)1155000 (YEN)346500
sorption $15,000 $7,500 $2,250
MSI Price List (10/96) expressed in Japanese Yen for sales in Japan Molecular Simulations Inc.
SOFTWARE DESCRIPTION COMMERCIAL GOVERNMENT ACADEMIC
--------------------- ---------- ---------- --------
Structure Image Structure Image: Simulates HRTEM images and dynamical (YEN)1540000 (YEN)770000 (YEN)231000
structimage diffraction patterns in crystals, interfaces, layered materials $10,000 $5,000 $1,500
and defects. Requires InsightIIoSolids_Builder.
Structure Refine Structure Refine: Interactive Reitveld refinement of Crystal (YEN)1540000 (YEN)770000 (YEN)231000
structrefine Structures through GSAS interface. Part of Catalysis $10,000 $5,000 $1,500
Consortium. Requires Insight II.
Structure Solve Structure Solve: Simulated Annealing tools for solving (YEN)1540000 (YEN)770000 (YEN)231000
structsolve structures of organic and inorganic materials. Part of $10,000 $5,000 $1,500
Catalysis Consortium. Requires Insight II and Solids
Simulation.
Super CHARMm Super CHARMm: Comprehensive force field and program for (YEN)26950000 (YEN)13475000 (YEN)4042500
supercharmm energy calculations. Includes extensive parameter library. $175,000 $87,500 $26,250
Supercomputers only. Includes source code. Host-locked
license.
Super Discover Super Discover: A molecular mechanics simulation (YEN)26950000 (YEN)13475000 (YEN)4042500
superdiscover environment offering energy minimization, dynamics and $175,000 $87,500 $26,250
Monte Carlo techniques. Supercomputers only. Host-locked license.
Super Dmol Super Dmol: Local Density Functional quantum mechanics (YEN)13860000 (YEN)6930000 (YEN)2079000
superdmol code. molecular systems only. Symmetry supported. $90,000 $45,000 $13,500
Supercomputer version. InsightII Recommended
Super X-PLOR Super X-PLOR: Software for refinement of x-ray structures for (YEN)30800000 (YEN)15400000 (YEN)4620000
superxplor Category 3 machines. Supercomputers only. Includes source $200,000 $100,000 $30,000
code. Host-locked license.
Super X-PLOR/DG Super X-PLOR/DG: Software for refinement of x-ray structures (YEN)25410000 (YEN)12705000 (YEN)3811500
superxplordg for supercomputers. Includes source code. Host-locked $165,000 $82,500 $24,750
license.
Super Super X-PLOR/Refine: Software for refinement of x-ray (YEN)25410000 (YEN)12705000 (YEN)3811500
superxplorref structures for supercomputers. Includes source code. $165,000 $82,500 $24,750
Host-locked license.
▇▇▇▇▇▇▇ ▇▇▇▇▇▇▇: Provides Rapide estimation of Many polymer (YEN)1540000 (YEN)770000 (YEN)231000
▇▇▇▇▇▇▇ properties. Requires Insight II. $10,000 $5,000 $1,500
System Guide System Guide (YEN)6160 (YEN)6160 (YEN)6160
docsystguide $40 $40 $40
Token Guide Token Guide (YEN)5390 (YEN)5390 (YEN)5390
doctoken $35 $35 $35
Training-1 Day Training: Installation, new customer orientation and (YEN)231000 (YEN)231000 (YEN)0
train 1 daycust demonstration. Customer pays travel costs. $1,500 $1,500 N/A
Training-2 Day Training: On Site Customized Workshop with a maximum of (YEN)770000 (YEN)616000 (YEN)462000
train2daycust 12 attendees. Customers provides machines and facility, MSI $5,000 $4,000 $3,000
provides instructor and materials.
Training-Workshop Training: Prepackaged Workshop Materials (5 copies) for (YEN)154000 (YEN)154000 (YEN)154000
trainmaterials self-run workshops. Choose from 8 units. $1,000 $1,000 $1,000
Training-2 Day Training: Regional Workshops with 10-15 attendees including (YEN)154000 (YEN)77000 (YEN)61600
train2daystd lecture and hands-on training. Price per attendee. Schedule $1,000 $500 $400
published on WWW.
Turbomole Turbomole: (YEN)4235000 (YEN)2117500 (YEN)635250
turbomole $27,500 $13,750 $4,125
Turbomole User Turbomole User Guide (YEN)6160 (YEN)6160 (YEN)6160
docturbomole $40 $40 $40
MSI Price List (10/96) expressed in Japanese Yen for sales in Japan Molecular Simulations Inc.
SOFTWARE DESCRIPTION COMMERCIAL GOVERNMENT ACADEMIC
--------------------- ---------- ---------- --------
TurboNMR TurboNMR: Requires Insight II and Turbomole. (YEN)2310000 (YEN)1155000 (YEN)346500
turbonmr $15,000 $7,500 $2,250
Viscoelasticity Viscoelasticity: Estimates the Dynamical mechanical (YEN)1540000 (YEN)770000 (YEN)231000
viscoelas response of dilute polymer solutions.Requires Insight II. $10,000 $5,000 $1,500
X-AutoFit X-AutoFit: Chain tracing and model building for protein (YEN)3542000 (YEN)1771000 (YEN)531300
xautofit crystallography. Requires QUANTA. X-Build recommended. $23,000 $11,500 $3,450
Host-locked license.
X-AutoFit/X-Build X-AutoFit/X-Build bundle: (YEN)6314000 (YEN)3157000 (YEN)947100
xautofitxbuild $41,000 $20,500 $6,150
X-AutoFit/X-Build/X- X-AutoFit/X-Build/X-Ligand bundle: (YEN)9086000 (YEN)4543000 (YEN)1362900
xautofitxbuildxligand $59,000 $29,500 $8,850
X-AutoFit/X-Ligand X-AutoFit/X-Ligand bundle: (YEN)6314000 (YEN)3157000 (YEN)947100
xautofitxligand $41,000 $20,500 $6,150
X-Build X-Build: Final model building, interface to X-PLOR. Requires (YEN)3542000 (YEN)1771000 (YEN)531300
xbuild QUANTA, X-PLOR. Includes X-SOLVATE. Host-locked $23,000 $11,500 $3,450
license.
X-Build/X-Ligand X-Build/X-Ligand bundle: (YEN)6314000 (YEN)3157000 (YEN)947100
xbuildxligand $41,000 $20,500 $6,150
X-Ligand X-Ligand: (YEN)3542000 (YEN)1771000 (YEN)531300
xligand $23,000 $11,500 $3,450
X-PLOR Reference X-PLOR Reference (YEN)6930 (YEN)6930 (YEN)6930
docxplor $45 $45 $45
X-PLOR X-PLOR: Software for x-ray and NMR structure determination (YEN)6160000 (YEN)3080000 (YEN)924000
xplor and refinement. Host-locked license. $40,000 $20,000 $6,000
X-PLOR/DG X-PLOR/DG: Software for NMR structure determination (YEN)4620000 (YEN)2310000 (YEN)693000
xplordg including distance geometry. Host-locked license. $30,000 $15,000 $4,500
X-PLOR/Refine X-PLOR/Refine: Software for refinement of x-ray structures. (YEN)4620000 (YEN)2310000 (YEN)693000
xplorrefine Host-locked license. $30,000 $15,000 $4,500
X-Ray Structure X-Ray Structure Analysis User's Guide (YEN)5390 (YEN)5390 (YEN)5390
docqxray $35 $35 $35
XSight XSight: Comprehensive system for protein crystallography. (YEN)9240000 (YEN)4620000 (YEN)1386000
xsight $60,000 $30,000 $9,000
Zindo User Guide XSIGHT User Guide (YEN)11550 (YEN)11550 (YEN)11550
docxsight $75 $75 $75
Xtal View Xtal View: Phasing and model fitting. (YEN)4620000 (YEN)2310000 (YEN)693000
xtalview $30,000 $15,000 $4,500
XtalView User Guide XtalView User Guide (YEN)7700 (YEN)7700 (YEN)7700
docxtalview $50 $50 $50
Zindo Zindo: (YEN)3850000 (YEN)1925000 (YEN)577500
zindo $25,000 $12,500 $3,750
Zindo User Guide Zindo User Guide (YEN)6930 (YEN)6930 (YEN)6930
doczindo $45 $45 $45
MSI Price List (10/96) expressed in Japanese Yen for sales in Japan Molecular Simulations Inc.
SOFTWARE DESCRIPTION COMMERCIAL GOVERNMENT ACADEMIC
------------------------------------------------------------------ ---------- ---------- --------
Affinity Affinity: Flexibly and automatically docks potential ligands $ 13,000 $ 6,500 $ 1,950
affinity into an active site. Requires Insight II and Discover.
Affinity User Guide Affinity User Guide $ 59 $ 59 $ 59
docaffinity
Amorphous Cell Amorphous Cell: Construction and Analysis tools for $ 26,000 $ 13,000 $ 3,900
amorphcell amorphous bulk polymers and interfacial phenomena.
Requires Insight II.
Apex-3D Apex-3D: Requires Insight II. $ 52,000 $ 26,000 $ 7,800
apex3d
Apex-3D User Guide Apex-3D User Guide $ 65 $ 65 $ 65
docapex3d
AXXESS (1 user) Axxess: X-terminal access to Insight II. Prices are per $ 7,150 $ 3,575 $ 1,073
axxess01 license. Requires Insight II to be licensed on the host
workstation. Annual license.
AXXESS (2-5 user) Axxess: X-terminal access to Insight II. Prices are per $ 5,363 $ 2,682 $ 805
axxess02 license. Requires Insight II to be licensed on the host
workstation. Annual license.
AXXESS (6+ user) Axxess: X-terminal access to Insight II. Prices are per $ 4,485 $ 2,243 $673.40
axxess06 license. Requires Insight II to be licensed on the host
workstation. Annual license.
Biopolymer Biopolymer: Requires Insight II. $ 16,250 $ 8,125 $ 2,438
biopolymer
Brookhaven Protein Brookhaven Protein Databank: Database of protein crystal $ 1,300 $ 1,300 $ 1,300
bnlpdb01 and NMR structures from BNL. One copy. Annual license.
Brookhaven Protein Brookhaven Protein Databank: Database of protein crystal $ 2,340 $ 2,340 $ 2,340
bnlpdb02 and NMR structures from BNL. Two updates. Annual
license.
Brookhaven Protein Brookhaven Protein Databank: Database of protein crystal $ 4,420 $ 4,420 $ 4,420
bnlpdb04 and NMR structures from BNL. Four updates. Annual
license.
C2 1.5 New C2 1.5 New Features Supplement $ 98 $ 98 $ 98
docc215new
C2 1.6 New C2 1.6 New Features Supplement $ 98 $ 98 $ 98
docc216new
C2.ADF C2.ADF: Amsterdam Density Functional code. $ 29,250 $ 14,625 $ 4,388
c2adf Executable only. Floating license.
C2.ADF Interface C2.ADF Interface: Provides an interface to the Amsterdam $ 9,750 $ 4,875 $ 1,463
c2adfint Density Functional program. User interface only. Floating
license.
C2.Alignment C2.Alignment: Molecular similarity and superpositioning $ 6,500 $ 3,250 $ 975
c2alignment methods. Floating license.
C2.Amorphous C2.Amorphous Builder: Builds models of amorphous $ 6,500 $ 3,250 $ 975
c2amorphbldr polymers and polymer/solvent systems. Floating license.
C2.Analog Builder C2.Analog Builder: Builds a congeneric collection/library of $ 6,500 $ 3,250 $ 975
c2analogbldr chemical structures. Floating license.
C2.Blends C2.Blends: Predicts phase behavior and phase diagrams. $ 19,500 $ 9,750 $ 2,925
c2blends Requires ▇▇.▇▇▇. Floating license.
C2 Builders User C2 Builders User Reference $ 98 $ 98 $ 98
docc2builder
C2.CASTEP C2.CASTEP: A quantum mechanics code for materials $ 55,250 $ 27,625 $ 8,288
c2castep science, the solid state, and surfaces. Executable only.
Floating license.
MSI Price List (10/96) expressed in US dollars for sales in Korea Molecular Simulations Inc.
SOFTWARE DESCRIPTION COMMERCIAL GOVERNMENT ACADEMIC
------------------------------------------------------------------ ---------- ---------- --------
C2.CASTEP C2.CASTEP Interface: Provdes an interface to the CASTEP $ 9,750 $ 4,875 $ 1,463
c2castepint program. Requires C2.Crystal Builder. C2.SurfaceBuilder
recommended. User interface only. Floating license.
C2.Conformers C2.Conformers: Provides conformational search algorithms $ 9,750 $ 4,875 $ 1,463
c2conformers and analysis tools for molecular structures. Requires
▇▇.▇▇▇. ▇▇.▇▇▇▇ recommended for Life Science
applications. Floating license.
C2.Crystal Builder C2.Crystal Builder: 3-D periodic crystal structure $ 6,500 $ 3,250 $ 975
c2crystalbldr construction and display. Floating license.
C2.▇▇▇▇▇▇▇ ▇▇▇▇▇▇ C2.▇▇▇▇▇▇▇ ▇▇▇▇▇▇: Minimizes the energy of molecular $ 6,500 $ 3,250 $ 975
c2crystalpckr crystals under full symmetry conditions. Requires
C2.Crystal Builder. Floating license.
C2.DB Access C2.DB Access: Provides access to Catalyst and MDL ISIS $ 6,500 $ 3,250 $ 975
c2dbaccess database searching programs. Requires Catalyst/Info or
MDL ISIS. Floating license.
C2.Descriptor+ C2.Descriptor+: Materials Science QSAR descriptors. $ 6,500 $ 3,250 $ 975
c2descriptor Requires C2.QSAR+. C2.Genetic Algorithms and
C2.Analog Builder recommended. Floating license.
C2.Descriptor+ C2.Descriptor+: Materials Science QSAR descriptors. $ 6,500 $ 3,250 $ 975
c2desc1 Requires C2.QSAR+. C2.Genetic Algorithms and
C2.Analog Builder recommended. Floating license.
C2 Diffraction and C2 Diffraction and Microscopy User's Reference $ 98 $ 98 $ 98
docc2diffmicro
C2.Diffraction-Amor C2.Diffraction-Amorphous: Simulates non-crystalline $ 13,000 $ 6,500 $ 1,950
c2diffamorph powder and fiber diffraction patterns and radial distribution
functions. Floating license.
C2.Diffraction-Cryst C2.Diffraction-Crystal: Simulates powder, fiber and single $ 13,000 $ 6,500 $ 1,950
c2diffcrystal crystal diffraction patterns. Requires C2.Crystal Builder.
Floating license.
C2.Diffraction-Fault C2.Diffraction-Faulted: Simulates powder diffraction from $ 9,750 $ 4,875 $ 1,463
c2difffault faulted or layered structures. Requires C2.Crystal Builder.
Floating license.
C2.Diversity C2.Diversity: Provides diversity/similarity selection $ 45,500 $ 22,750 $ 6,825
c2diversity techniques and topological/information descriptors for the
characterization of same. Requires C2.QSAR+. Floating
license.
C2.DLS C2.DLS: Predicts structures of inorganic framework crystals $ 9,750 $ 4,875 $ 1,463
c2dls using geometric refinement. Requires C2.Crystal Builder.
Floating license.
C2.Dynamics C2.Dynamics: Performs molecular dynamics simulations and $ 19,500 $ 9,750 $ 2,925
c2dynamics analysis. Requires ▇▇.▇▇▇. Floating license.
C2.EXAFS C2.EXAFS: Simulates, analyzes and refines EXAFS data. $ 26,000 $ 13,000 $ 3,900
c2exafs Includes EXCURVE code. Floating license.
C2.Force Field C2.Force Field Editor: Provides force field customization $ 6,500 $ 3,250 $ 975
c2ffeditor tools. Requires ▇▇.▇▇▇. Floating license.
C2.Gaussian C2.Gaussian Interface: Provides an interface to the $ 9,750 $ 4,875 $ 1,463
c2gaussian non-empirical Gaussian program. User interface only.
Floating license.
C2.Genetic C2.Genetic Algorithims: Genetic function approximation $ 6,500 $ 3,250 $ 975
c2geneticalgo applied to QSAR. Floating license.
MSI Price List (10/96) expressed in US dollars for sales in Korea Molecular Simulations Inc.
SOFTWARE DESCRIPTION COMMERCIAL GOVERNMENT ACADEMIC
--------------------- ---------- ---------- --------
C2.HRTEM C2.HRTEM: Simulates HRTEM images and dynamical $ 19,500 $ 9,750 $ 2,925
c2hrtem diffraction patterns in crystals, interfaces and defects.
Requires C2.Crystal Builder. Floating license.
C2 Hypothesis and C2 Hypothesis and Receptor Models User's Reference $ 98 $ 98 $ 98
docc2hyporec
C2 Installation and C2 Installation and Administration Guide $ 65 $ 65 $ 65
docc2install
C2.Interface Builder C2.Interface Builder: Definition and display of interfaces between $ 3,250 $ 1,625 $ 488
c2interfacebldr crystal structures. Requires C2.Crystal Builder.
Floating license.
C2.LEED/RHEED C2.LEED/RHEED: Simulates kinematic Low Energy and $ 9,750 $ 4,875 $ 1,463
c2leedrheed Reflection High Energy Electron Diffraction patterns.
Requires C2.Surface Builder. Floating license.
C2 Material Science C2 Material Science Tutorial Guide $ 98 $ 98 $ 98
docc2matsci
C2.Mechanical C2.Mechanical Properties: Predicts the mechanical behavior $ 13,000 $ 6,500 $ 1,950
c2mechprops of bulk materials. Requires C2.Crystal Builder, ▇▇.▇▇▇,
C2.Minimizer, C2.Dynamics. Floating license.
C2.MFA C2.MFA: Molecular field analysis for 3D QSAR. Requires $ 26,000 $ 13,000 $ 3,900
c2mfa ▇▇.▇▇▇, ▇▇.▇▇▇▇+, C2.FFEditor. Floating license.
C2.Minimizer C2.Minimizer: Performs energy minimization of molecular and $ 13,000 $ 6,500 $ 1,950
c2minimizer periodic structures. Requires ▇▇.▇▇▇. Floating license.
C2.MMFF C2.MMFF: Provides Merck Molecular Modeling Force Field for $ 13,000 $ 6,500 $ 1,950
c2mmff use with Drug Discovery applications. Requires ▇▇.▇▇▇.
Floating license.
C2 Modeling C2 Modeling Environment User's Reference $ 98 $ 98 $ 98
docc2modenv
C2.MOPAC C2.MOPAC Interface: Provides an interface to the $ 6,500 $ 3,250 $ 975
c2mopac semi-empirical MOPAC program. Includes MOPAC 6.0.
Floating license.
C2.Morphology C2.Morphology: Predicts and analyzes crystal morphology $ 19,500 $ 9,750 $ 2,925
c2morphology from internal crystal structure. Requires C2.Crystal Builder,
▇▇.▇▇▇. Floating license.
▇▇.▇▇▇▇ Force Field ▇▇.▇▇▇▇ Force Field: Open force field includes library of $ 13,000 $ 6,500 $ 1,950
c2off standard materials force fields. Includes Dreiding, Universal,
and other force fields. Floating license.
C2.Polymer Builder C2.Polymer Builder: Construction of polymer chains. $ 6,500 $ 3,250 $ 975
c2polymerbldr Includes monomer libraries. Floating license.
C2.Polymer C2.Polymer Properties: Calculates polymer physical $ 13,000 $ 6,500 $ 1,950
c2polyprops properties and structure. Floating license.
C2.Polymorph C2.Polymorph: Predicts polymorphs of organic molecules. $ 97,500 $ 97,500 $ 97,500
c2polymorph Requires C2.Crystal Builder, ▇▇.▇▇▇. Floating license.
C2.Powder Indexing C2.Powder Indexing: Allows powder diffraction patterns to be $ 6,500 $ 3,250 $ 975
c2powderindx indexed. Includes TREOR code. Floating license.
C2 Property C2 Property Prediction User's Reference $ 98 $ 98 $ 98
docc2proppred
C2.QSAR+ C2.QSAR+: Comprehensive toolkit for 2D and 3D QSAR. $ 26,000 $ 13,000 $ 3,900
c2qsar Floating license.
C2 QSAR+ User's C2 QSAR+ User's Reference $ 98 $ 98 $ 98
docc2qsar
MSI Price List (10/96) expressed in US dollars for sales in Korea Molecular Simulations Inc.
SOFTWARE DESCRIPTION COMMERCIAL GOVERNMENT ACADEMIC
--------------------- ---------- ---------- --------
C2 Quantum C2 Quantum Mechanics Workbench User's Reference $ 98 $ 98 $ 98
docc2qmw
C2.Receptor C2.Receptor: Toolkit for creation and evaluation of $ 13,000 $ 6,500 $ 1,950
c2receptor pseudo-receptor models. Floating license.
C2.Rietveld C2.Rietveld: Performs crystal structure refinement and $ 19,500 $ 9,750 $ 2,925
c2rietveld quantitative phase analysis using DBWS or GSAS. Requires
C2.Crystal Builder. Includes DBWS code. Floating license.
C2.SDK C2.SDK Programmer's Guide $ 98 $ 98 $ 98
docc2sdkprog
C2.SDK-3rd party C2.SDK: Refer all third party opportunities directly to New N/A N/A N/A
c2sdk3rdparty Business Development (▇▇▇▇ ▇▇▇▇▇ Santi).
C2.SDK-internal first C2.SDK: Software Developers Kit. Requires C2.Visualizer. N/A N/A $ 10,400
c2sdkfacds Multi-user SDK license for an academic resaearch group.
Includes full support for one designated user.
C2.SDK-internal first C2.SDK: Software Developers Kit. Requires C2.Visualizer. N/A N/A $ 6,500
c2sdkfac Multi-user SDK license for an academic resaearch group.
Support not included.
C2.SDK-internal first C2.SDK: Software Developers Kit. Requires C2.Visualizer. N/A N/A $ 3,900
c2sdkres Multi-user SDK license for an academic research group.
Support not included. Additional licenses priced at $500
each.
C2.SDK-internal C2.SDK: Software Developers Kit. Requires C2.Visualizer. $ 3,900 $ 3,900 N/A
c2skdintadd Support limited to two named users at site (one for academic);
training not included in price. Price per additional license.
C2.SDK-internal first C2.SDK: Software Developers Kit. Requires C2.Visualizer. $ 52,000 $ 52,000 N/A
c2skdintfirst Support limited to two named users at site (one for academic);
training not included in price.
C2 Simulation Tools C2 Simulation Tools User's Reference $ 98 $ 98 $ 98
docc2simtool
C2.Sorption C2.Sorption: Predicts adsorption properties of microporous $ 19,500 $ 9,750 $ 2,925
c2sorption materials. Requires C2.Crystal Builder, ▇▇.▇▇▇. Floating
license.
C2.Super ADF C2.Super ADF: Amsterdam Density Functional code for $ 87,750 $ 43,875 $ 13,163
c2superadf supercomputers. Executable only. Host-locked license.
C2.Super CASTEP C2.CASTEP: A quantum mechanics code for materials $165,750 $ 82,875 $ 24,863
c2supercastep science, the solid state, and surfaces. Executable only.
Host-locked license.
C2.Surface Builder C2.Surface Builder: Surface chemistry 2-D periodic model $ 3,250 $ 1,625 $ 488
c2surfacebldr builder. Requires C2.Crystal Builder. Floating license.
C2 Using Command C2 Using Command Scripts $ 65 $ 65 $ 65
docc2command
C2.Visualizer C2.Visualizer: Comprehensive chemical computing $ 6,500 $ 6,500 $ 975
c2visualizer environment. Required core product. Floating license.
C2.X-GEN C2.X-GEN: Integrated package for the processing and $ 19,500 $ 9,750 $ 2,925
c2xgen reduction of diffraction data from area detectors. Requires
C2.Visualizer. Floating license.
Catalysis User Catalysis User Guide $ 65 $ 65 $ 65
doccatalysis
MSI Price List (10/96) expressed in US dollars for sales in Korea Molecular Simulations Inc.
SOFTWARE DESCRIPTION COMMERCIAL GOVERNMENT ACADEMIC
-------------------- ---------- ---------- --------
Catalysis and Catalysis/Sorption Consortium: Customers must purchase $273,000 N/A N/A
conscatsorp licenses for Insight II, Discover, Solids Builder, Sorption,
Solids Docking, and Reaction Patterns for $60,000. Members
receive 3 copies of all software developed during Phase II.
Catalyst Installation Guide and Release Notes $ 33 $ 33 $ 33
doccatinstall
Catalyst Tutorials $ 59 $ 59 $ 59
doccattutorial
Catalyst/ACD Catalyst/ACD: Available Chemicals Directory. Requires $ 13,000 $ 13,000 $ 13,000
catacd01 Catalyst/Info. Annual License.
Catalyst/ACD (2-10 Catalyst/ACD: Available Chemicals Directory. Requires $ 24,700 $ 24,700 $ 24,700
catacd02 Catalyst/Info. Annual License.
Catalyst/ACD Catalyst/ACD: Available Chemicals Directory. Requires $ 32,500 $ 32,500 $ 32,500
catacd11 Catalyst/Info. Annual License.
Catalyst/BioByte Catalyst/BioByte Master File: 25,000 small molecules, $ 9,100 $ 9,100 $ 9,100
catbiobyte Pomona College Medicinal Chemistry. Requires
Catalyst/Info. Annual license.
Catalyst/View Catalyst/Compare: Provides query-query, $ 28,600 $ 14,300 $ 4,290
catcompare compound-compound, and query-compound comparision and
overaly functionality. Floating License.
Catalyst/DB Server Catalyst/DB Server: Database server for Catalyst. Requires $ 18,200 $ 9,100 $ 2,730
catdbserver Catalyst/View. Floating license.
Catalyst/Derwent's Catalyst/Derwent: Catalog of 40,000 compounds and $ 35,100 $ 35,100 $ 35,100
carderwent11 descriptive data. Requires Catalyst/Info. Annual license.
Catalyst/Derwent Catalyst/Derwent: Catalog of 40,000 compounds and $ 19,500 $ 19,500 $ 19,500
catderwent01 descriptive data. Requires Catalyst/Info. Annual license.
Catalyst/Derwent's Catalyst/Derwent: Catalog of 40,000 compounds and $ 29,250 $ 29,250 $ 29,250
catderwent02 descriptive data. Requires Catalyst/Info. Annual license.
Catalyst/Hypo Catalyst/Hypo: Allows additional simultaneous batch $ 54,600 $ 27,300 $ 8,190
cathypo hypothesis generation. Requires Catalyst/View. Floating
license.
Catalyst/Info Catalyst/Info: Integrated 1D, 2D, 3D chemical database $ 36,400 $ 18,200 $ 5,460
catinfo system. Requires Catalyst/View. Floating license.
Catalyst/Maybridge Catalyst/Maybridge: Catalog of 47,000 compounds. Included $ 0 $ 0 $ 0
catmaybridge with Catalyst/Info. Annual license.
Catalyst/NCI Catalyst/NCI: National Cancer Institute database with 98,000 $ 0 $ 0 $ 0
catnci registered compounds. Included with Catalyst/Info. Annual
license.
Catalyst/Shape Catalyst/Shape: Performs multiconformation shape similarity $ 23,400 $ 11,700 $ 3,510
catshape searching. Calculates 3D shape descriptors for the
characterization of combinatorial libraries. Requires
Catalyst/View and Catalyst/DB Server. Catalyst/Info
recommended. Floating license.
Catalyst/View Catalyst/View: Drug discovery environment for identifying $ 35,100 $ 35,100 $ 5,265
catview active, structurally diverse leads for both the medicinal
chemist and modeler. Floating license.
Catalyst/View Catalyst/Visualizer: Drug discover environment for $ 6,500 $ 6,500 $ 975
catvisualizer identifying active, structurally diverse leads for both the
medicinal chemist and modeler. Floating license.
CFF 95 CFF 95: Requires Discover. $ 19,500 $ 9,750 $ 2,925
cff95
MSI Price List (10/96) expressed in US dollars for sales in Korea Molecular Simulations Inc.
SOFTWARE DESCRIPTION COMMERCIAL GOVERNMENT ACADEMIC
-------------------- ---------- ---------- --------
Characterize Characterize: Base Module requirement for most analytical $ 3,900 $ 1,950 $ 585
characterize simulations in InsightII. Includes geometric analysis tools.
Part of Catalysis Consortium. Requires Insight II.
CHARMm Command CHARMm Command Dictionary Part One and Two $ 46 $ 46 $ 46
doccharmmdict
CHARMm CHARMm: Comprehensive force field and program for energy $ 50,700 $ 25,350 $ 7,605
charmm calculations. Includes extensive parameter library.
Host-locked license.
CHARMm Principles CHARMm Principles $ 65 $ 65 $ 65
doccharmmprin
CHARMm/MMFF CHARMm/MMFF: Merck Molecular force field option to $ 13,000 $ 6,500 $ 1,950
charmmmmff CHARMm. Includes extensive parameter library. Requires
QUANTA, CHARMm. Host-locked license.
CombiChem (1996 CombiChem Consortium: Customers must also purchase $110,500 $ 0 $ 0
conscombi licenses for C2 Drug Discovery software. Members receive
software licenses per agreement.
ConFirm ConFirm: Conformational model generator using ▇▇▇▇▇▇ to $ 26,000 $ 13,000 $ 3,900
confirm promote "coverage". Floating license.
ConFirm User's ConFirm User's Guide $ 65 $ 65 $ 65
docconfirm
Consensus Consensus: Requires Insight II and Homology. $ 23,400 $ 11,700 $ 3,510
consensus
Consensus User Consensus User Guide $ 59 $ 59 $ 59
docconsensus
Consulting (daily) $ 2,340 $ 2,340 $ 2,340
consulting
Converter Converter: Requires Insight II and Sketcher. $ 32,500 $ 16,250 $ 4,875
converter
Converter User Converter User Guide $ 39 $ 39 $ 39
docconverter
Crystal Cell Crystal Cell: Study Energetics of Crystalline polymer $ 13,000 $ 6,500 $ 1,950
crystalcell systems. Requires Insight II.
DeCipher DeCipher: Requires Insight II, Analysis, and Discover. $ 13,000 $ 6,500 $ 1,950
decipher
DeCipher User DeCipher User Guide $ 46 $ 46 $ 46
docdecipher
DelPhi and DelPhi and Solvation User Guide $ 65 $ 65 $ 65
docdelphi
DelPhi DelPhi: Requires Insight II. $ 46,800 $ 23,400 $ 7,020
delphi
Diffraction Diffraction: X-ray and Electron single crystal and powder $ 13,000 $ 6,500 $ 1,950
diffraction Diffaction, Crystalline, Amorphous and Fiber diffraction.
Requires Insight II and Characterize.
DISCON/NOESYSI DISCON/NOESYSIM: Software for generating restraints $ 8,125 $ 4,063 $1,219.40
discon using relaxation matrix analysis. For use with NMR Structure
Determination. Host-locked license.
Discover (3 parts) Discover (3 parts) $ 98 $ 98 $ 98
docdiscover
MSI Price List (10/96) expressed in US dollars for sales in Korea Molecular Simulations Inc.
SOFTWARE DESCRIPTION COMMERCIAL GOVERNMENT ACADEMIC
-------------------- ---------- ---------- --------
Discover Discover: A molecular mechanics simulation environment $ 50,700 $ 25,350 $ 7,605
discover offering energy minimization, dynamics and Monte Carlo
techniques. Requires Insight II.
Dmol Dmol: Local Density Functional quantum mechanics code. $ 39,000 $ 19,500 $ 5,850
dmol molecular systems only. Symmetry supported.
InsightII Recommended
DMol User Guide DMol User Guide $ 65 $ 65 $ 65
docdmol
DSolid DSolid: Requires Insight II. $ 65,000 $ 32,500 $ 9,750
dsolid
EOM (1996 fee; EOM Consortium: Customers must also purchase licenses $182,000 $ 0 $ 0
conseom for Insight II, Discover, and Solids Builder for $40,000 and at
least one EOM code product for $45,000. Members receive
3 copies of all software developed during Phase II.
EOM-DSolid EOM-DSolid $ 65 $ 65 $ 65
docdsolid
EOM-ESOCS EOM-ESOCS $ 52 $ 52 $ 52
docesocs
EOM-Fast Stucture EOM-Fast Stucture $ 52 $ 52 $ 52
docfaststr
EOM-Plane Wave EOM-Plane Wave $ 52 $ 52 $ 52
docplanewave
ESOCS ESOCS: Requires Insight II. $ 65,000 $ 32,500 $ 9,750
esocs
EXAFS EXAFS: FEFF EXAFS scattering simulation. Requires Insight $ 6,500 $ 3,250 $ 975
exafs II and Characterize.
FastStruct/SimAnn FastStruct/SimAnn: Requires Insight II. $ 65,000 $ 32,500 $ 9,750
faststruct
▇▇▇▇▇ for Windows ▇▇▇▇▇ for Windows: $ 1,950 $ 1,950 $ 1,300
felixwin01
▇▇▇▇▇ for Windows ▇▇▇▇▇ for Windows: $ 6,500 $ 6,500 $ 4,323
felixwin05
▇▇▇▇▇ for Windows ▇▇▇▇▇ for Windows: $ 9,750 $ 9,750 $ 6,500
felixwin10
▇▇▇▇▇ for Windows ▇▇▇▇▇ for Windows: $ 19,500 $ 19,500 $ 13,000
felixwin25
▇▇▇▇▇ for Windows ▇▇▇▇▇ for Windows: Requires an existing license for ▇▇▇▇▇ $ 384 $ 384 $ 254
felixwinupgr01 for Windows.
▇▇▇▇▇ for Windows ▇▇▇▇▇ for Windows: Requires an existing license for ▇▇▇▇▇ $ 1,300 $ 1,300 $ 813
felixwinupgr10 for Windows.
▇▇▇▇▇ User Guide, ▇▇▇▇▇ User Guide, Tutorial, and Reference Guide $ 98 $ 98 $ 98
docfelix
▇▇▇▇▇-2D ▇▇▇▇▇-2D: $ 26,000 $ 13,000 $ 3,900
felix2d
▇▇▇▇▇-Assign ▇▇▇▇▇-Assign: Requires ▇▇▇▇▇-2D or ▇▇▇▇▇-ND. $ 39,000 $ 19,500 $ 5,850
felixassign
▇▇▇▇▇-Model ▇▇▇▇▇-Model: Requires ▇▇▇▇▇-2D or ▇▇▇▇▇-ND. $ 19,500 $ 9,750 $ 2,925
felixmodel
▇▇▇▇▇-ND ▇▇▇▇▇-ND: $ 39,000 $ 19,500 $ 5,850
felixnd
MSI Price List (10/96) expressed in US dollars for sales in Korea Molecular Simulations Inc.
SOFTWARE DESCRIPTION COMMERCIAL GOVERNMENT ACADEMIC
-------------------- ---------- ---------- --------
▇▇▇▇▇-X-Remote ▇▇▇▇▇-X-Remote: Requires any ▇▇▇▇▇. $ 6,500 $ 3,250 $ 975
felixxremote
File Formats File Formats Reference $ 52 $ 52 $ 52
docfileformats
Flexiblend Flexiblend: Requires Insight II and Discover. $ 13,000 $ 6,500 $ 1,950
flexiblend
HipHop HipHop: Feature-based alignment tool for 3D QSAR and 3D $ 26,000 $ 13,000 $ 3,900
hiphop search queries. Floating license.
HipHop User's Guide HipHop User's Guide $ 65 $ 65 $ 65
dochiphop
Homology Homology: Requires Insight II and Discover. $ 39,000 $ 19,500 $ 5,850
homology
Homology User Guide Homology User Guide $ 65 $ 65 $ 65
dochomology
Insight (2 parts) Insight (2 parts) $ 65 $ 65 $ 65
docinsight
Insight 300 Release Insight 300 Release Documentation $ 26 $ 26 $ 26
docins300
Insight 950 Release Insight 950 Release Documentation $ 26 $ 26 $ 26
docins950
Insight AXXESS Insight AXXESS User Guide $ 46 $ 46 $ 46
docaxxess
Insight II 4.0.0 Release Documentation $ 26 $ 26 $ 26
docins400
Insight II 4.0.0 User's Guide $ 65 $ 65 $ 65
docins400user
Insight II Insight II: General chemical modeling envioronment with $ 16,250 $ 8,125 $ 2,438
insight customizable macro interface.
Interphases Interphases: Calculate statistical properties of mono and $ 13,000 $ 6,500 $ 1,950
interphases bilayers in a polyemeric interphase system. Requires Insight
II.
IR_Raman IR_Raman: Simulation and display of Infra-Red vibrational $ 6,500 $ 3,250 $ ▇▇▇
▇▇▇▇▇▇▇ spectra and normal mode analysis. Requires Insight II and
Characterize.
License Guide License Guide $ 33 $ 33 $ 33
doclicense
Ligand Design User Ligand Design User Guide $ 39 $ 39 $ 39
docligand
▇▇▇▇ ▇▇▇▇: Requires Insight II. $ 39,000 $ 19,500 $ 5,850
▇▇▇▇
▇▇▇▇/ACD Ludi/ACD: Requires Ludi. $ 13,000 $ 6,500 $ 3,900
ludiacd
MADSYS: Provides phasing for multiple anomalous $ 13,000 $ 6,500 $ 1,950
madsys dispersion data. Requires XSIGHT.
MCSS/Hook MCSS/HOOK: Receptor structure-based ligand design with $ 29,250 $ 14,625 $ 4,388
mcsshook database search. Requires QUANTA, CHARMm. Host-locked
license.
MCSS/Hook User's MCSS/Hook User's Guide $ 65 $ 65 $ 65
docmcsshook
MSI Price List (10/96) expressed in US dollars for sales in Korea Molecular Simulations Inc.
SOFTWARE DESCRIPTION COMMERCIAL GOVERNMENT ACADEMIC
-------------------- ---------- ---------- --------
Miscibility Miscibility: Requires Insight II, Phase Diagram, Flexiblend, $ 13,000 $ 6,500 $ 1,950
miscibility and ▇▇▇▇▇▇▇.
Modeler Modeler (for Insight II): Provides automated homology $ 29,900 $ 14,950 $ 4,485
insmodeler modeling. Requires Insight II and Homology. Host-locked
license.
Modeler Modeler (for QUANTA): Provides automated homology $ 29,900 $ 14,950 $ 4,485
modeler modeling. Requires QUANTA. Host-locked license.
Morphology Morphology: Predicts and analyzes crystal morphology from $ 6,500 $ 3,250 $ 975
morphology internal crystal structure. Requires InsightII, Solids_Builder,
and Characterize.
Networks Networks: Monte Carlo technique for study network formation $ 13,000 $ 6,500 $ 1,950
networks and cross-linking. Requires Insight II.
NMR Compass NMR.Compass: Software for computer aided assignment and $ 32,500 $ 16,250 $ 4,875
nmrcompass analysis of multidimensional data. QUANTA recommended.
Host-locked license.
NMR.Compass User NMR.Compass User Guide $ 98 $ 98 $ 98
docnmrcompass
NMR Pipe NMR.Pipe: Software for multidimensional NMR spectral $ 39,000 $ 19,500 $ 5,850
nmrpipe processing. Stand-alone executable only; no integration with
NMR.Compass. Host-locked license.
NMR.Pipe User's NMR.Pipe User's Guide $ 33 $ 33 $ 33
docnmrpipe
NMR Refine NMR Refine Advance: Requires Insight II and Discover. $ 52,000 $ 26,000 $ 7,800
nmrrefineadv
NMR Refine NMR Refine Complete: Includes NMR Refine Advance and $ 78,000 $ 39,000 $ 11,700
nmrrefinecom NMR Refine DG. Requires Insight II and Discover.
NMR Refine DGII NMR Refine DGII: Requires Insight II. $ 39,000 $ 19,500 $ 5,850
nmrrefinedg
NMR Structure NMR Structure Determination: Software for structure $ 29,900 $ 14,950 $ 4,485
nmrstructure generation and strucuture analysis/evaluation. Requires
QUANTA. Host-locked license.
NMRchitect User NMRchitect User Guide $ 65 $ 65 $ 65
docnmrchitect
Open Interface Open Interface Programmer Guide $ 65 $ 65 $ 65
docopenint
Open Interface Open Interface: Requires Insight II. Annual license pricing $ 6,500 $ 6,500 $ 975
openint ($3333 license fee, $1667 maintenance fee).
PEFC Associate PEFC Associate Membership: Non-voting membership. $ 6,500 $ 3,250 $ 975
conspefcasso2 1 force field seat. No consortium software or databases.
No workshop attendance. Limited suppport. Not available for
new memberships. Price per year after first year.
PEFC Executive PEFC Executive Membership: Voting membership. 8 force $ 58,500 $ 29,250 $ 8,775
conspefcexec1 field seats. Site license for consortium software and
databases. Workshop attendance available at additional cost.
Support included. Price per year, 3 year commitment.
PEFC Executive PEFC Executive Membership: Voting membership. 8 force $ 32,500 $ 16,250 $ 4,875
conspefcexec2 field seats. Site license for consortium software and
databases. Workshop attendance available at additional cost.
Support included. Price per year after first 3 years.
MSI Price List (10/96) expressed in US dollars for sales in Korea Molecular Simulations Inc.
SOFTWARE DESCRIPTION COMMERCIAL GOVERNMENT ACADEMIC
-------------------- ---------- ---------- --------
PEFC Standard PEFC Standard Membership: Non-voting membership. 3 force $ 26,000 $ 0 $ 0
conspefcstd field seats. 1 workstation license for consortium software and
databases. Workshop attendance available at additional cost.
Support included. Price per year, 3 year commitment.
Phase Diagram Phase Diagram: Calculate liquid-liquid phase diagrams for $ 13,000 $ 6,500 $ 1,950
phasediagram polymer solutions and blends. Requires Insight II.
Plane Wave Plane Wave: Requires Insight II. $ 65,000 $ 32,500 $ 9,750
planewave
Polymer (3 parts) Polymer (3 parts) $ 130 $ 130 $ 130
docpolymer
Polymer (1-year: Polymer Consortium: No products included in corsortium $117,000 $ 0 $ 0
conspolymer01 price. Customers advised to purchase licenses for Insight II,
Discover, and a variety of Polymer modules.
Polymer (3-year: Polymer Consortium: No products included in corsortium $ 91,000 $ 0 $ 0
conspolymer03 price. Customers advised to purchase licenses for Insight II,
Discover, and a variety of Polymer modules. Price is per year.
Polymerizer Polymerizer: Construction of polymer chains, Including $ 9,750 $ 4,875 $ 1,463
polymerizer monomer libraries. Requires InsightII.
PolyNMR PolyNMR: Predicts NMR spectra for polymer chains. $ 13,000 $ 6,500 $ 1,950
polynmr Requires Insight II and RIS.
PRISM PRISM: Predicts polymer blends miscibility based on $ 13,000 $ 6,500 $ 1,950
prism chemical composition. Requires Insight II.
Profiles 3D User Profiles 3D User Guide $ 59 $ 59 $ 59
docprofiles3d
Profiles-3D Profiles-3D: Requires Insight II. $ 22,750 $ 11,375 $ 3,413
profiles3d
Protein Health Protein Health: Provides identification of structural anomalies. $ 13,000 $ 6,500 $ 1,950
health Requires QUANTA. Host-locked license.
Protein Modeling Protein Modeling: System for homology and structural $ 39,000 $ 19,500 $ 5,850
protein analysis of proteins. Requires QUANTA. Includes Protein
Design and Protein Health. Host-locked license.
QSPR QSPR: Quantitative Structure Property Relationships predicts $ 13,000 $ 6,500 $ 1,950
qspr properties for a wide range of thermoplastic materials.
Requires Insight II.
QUANTA 4.1 New QUANTA 4.1 New Features Supplement $ 65 $ 65 $ 65
docq41new
QUANTA Basic QUANTA Basic Operations $ 46 $ 46 $ 46
docqbasicops
QUANTA core QUANTA core: Complete molecular modeling environment. $ 26,000 $ 13,000 $ 3,900
quanta CHARMm strongly recommended. Host-locked license.
QUANTA QUANTA Generating and Displaying Molecules $ 46 $ 46 $ 46
docqgendisp
QUANTA NMR QUANTA NMR Structure Determination User's Guide $ 46 $ 46 $ 46
docqnmrstr
QUANTA Protein QUANTA Protein Homology Modeling Tutorial $ 46 $ 46 $ 46
docqhomology
QUANTA Protein QUANTA Protein User's Reference $ 46 $ 46 $ 46
docqprotein
MSI Price List (10/96) expressed in US dollars for sales in Korea Molecular Simulations Inc.
SOFTWARE DESCRITION COMMERCIAL GOVERNMENT ACADEMIC
------------------- ---------- ---------- --------
QUANTA QUANTA Simulation, Search, and Analysis $ 46 $ 46 $ 46
docqsimsearch
QUANTA96 New Features Supplement $ 65 $ 65 $ 65
docq96new
QuanteMM QuanteMM $ 65 $ 65 $ 65
docquantemm
QuanteMM QuanteMM: Hybrid QM/MM technique for optimizing large $ 19,500 $ 9,750 $ 2,925
quantemm or periodic structures. Can use Mopac, Dmol or Turbomole as
QM engine. Requires Insight II and Discover
Reaction Patterns Reaction Patterns: Reaction engineering toolkit. $ 13,000 $ 6,500 $ 1,950
reactpatterns Complimentary tools for evaluation reaction trends. Requires
Insight II.
RIS RIS: Calculate conformational properties of polymer chains. $ 13,000 $ 6,500 $ 1,950
ris Requires Insight II.
Search/Compare Search/Compare: Requires Insight II. $ 26,000 $ 13,000 $ 3,900
searchcomp
Search Compar Search Compar User Guide $ 65 $ 65 $ 65
docsearchcomp
Sketcher Sketcher: 2-D sketcher with ▇▇▇▇ ▇▇▇▇▇▇▇▇-geometry 3D $ 3,250 $ 1,625 $ 488
sketcher converter.
Solids Builder Solids Builder: Crystal Building 3-D periodic structures, 2-D $ 19,500 $ 9,750 $ 2,925
solidsbldr Surfaces and Interfaces. Requires Insight II. Includes Solids
Adjustment.
Solids Diffusion: Studies the behavior of molecules iwthin $ 13,000 $ 6,500 $ 1,950
solidsdiffusion microporous host materials. Requires Insight II, Discover.
Solids Docking Solids Docking: Highly automated procedures for investigation $ 19,500 $ 9,750 $ 2,925
solidsdocking of interactions of molecules with surfaces and porous
materials. Requires Insight II and Solids Builder and Discover .
Solids Simulation Solids Simulation: Lattice Minimization and Dynamics for $ 13,000 $ 6,500 $ 1,950
solidssimul Inorganic systems including Melt-Quench protocols for
creating silicate glasses. Requires Insight II.
Solids-NMR Solids-NMR: Predicts Si29 Solid State NMR pattern for $ 6,500 $ 3,250 $ 975
solidsnmr Zeolites. Should rtecommend TurboNMR for higher degree of
accuracy. Requires Insight II and Characterize.
Sorption Sorption: Requires Insight II, Solids Builder. $ 19,500 $ 9,750 $ 2,925
sorption
Structure Image Structure Image: Simulates HRTEM images and dynamical $ 13,000 $ 6,500 $ 1,950
structimage diffraction patterns in crystals, interfaces, layered material s
and defects. Requires InsightII.Solids_Builder.
Structure Refine Structure Refine: Interactive Reitveld refinement of Crystal $ 13,000 $ 6,500 $ 1,950
structrefine Structures through GSAS interface. Part of Catalysis
Consortium. Requires Insight II.
Structure Solve Structure Solve: Simulated Annealing tools for solving $ 13,000 $ 6,500 $ 1,950
structsolve structures of organic and inorganic materials. Part of
Catalysis Consortium. Requires Insight II and Solids
Simulation.
Super CHARMm Super CHARMm: Comprehensive force field and program for $227,500 $113,750 $ 34,125
supercharmm energy calculations. Includes extensive parameter library.
Supercomputers only. Includes source code. Host-locked
license.
MSI Price List (10/96) expressed in dollars for sales in Korea Molecular Simulations Inc.
SOFTWARE DESCRITION COMMERCIAL GOVERNMENT ACADEMIC
------------------- ---------- ---------- --------
Super Discover Super Discover: A molecular mechanics simulation $227,500 $113,750 $34,125
superdiscover environment offering energy minimization, dynamics and
Monte Carlo techniques. Supercomputers only. Host-locked license.
Super Dmol Super Dmol: Local Density Functional quantum mechanics $117,000 $ 58,500 $17,550
superdmol code. molecular systems only. Symmetry supported.
Supercomputer version. InsightII Recommended
Super X-PLOR Super X-PLOR: Software for refinement of x-ray structures for $260,000 $130,000 $39,000
superxplor Category 3 machines. Supercomputers only. Includes source
code. Host-locked license.
Super X-PLOR/DG Super X-PLOR/DG: Software for refinement of x-ray structures $214,500 $107,250 $32,175
superxplordg for supercomputers. Includes source code. Host-locked
license.
Super Super X-PLOR/Refine: Software for refinement of x-ray $214,500 $107,250 $32,175
superxplorref structures for supercomputers. Includes source code.
Host-locked license.
▇▇▇▇▇▇▇ ▇▇▇▇▇▇▇: Provides Rapide estimation of Many polymer $ 13,000 $ 6,500 $ 1,950
▇▇▇▇▇▇▇ properties. Requires Insight II.
System Guide System Guide $ 52 $ 52 $ 52
docsystguide
Token Guide Token Guide $ 46 $ 46 $ 46
doctoken
Training-1 Day Training: Installation, new customer orientation and $ 1,950 $ 1,950 $ 0
train 1 daycust demonstration. Customer pays travel costs.
Training-2 Day Training: On Site Customized Workshop with a maximum of $ 6,500 $ 5,200 $ 3,900
train2daycust 12 attendees. Customers provides machines and facility, MSI
provides instructor and materials.
Training-Workshop Training: Prepackaged Workshop Materials (5 copies) for $ 1,300 $ 1,300 $ 1,300
trainmaterials self-run workshops. Choose from 8 units.
Training-2 Day Training: Regional Workshops with 10-15 attendees including $ 1,300 $ 650 $ 520
train2daystd lecture and hands-on training. Price per attendee. Schedule
published on WWW.
Turbomole Turbomole: $ 35,750 $ 17,875 $ 5,363
turbomole
Turbomole User Turbomole User Guide $ 52 $ 52 $ 52
docturbomole
TurboNMR TurboNMR: Requires Insight II and Turbomole. $ 19,500 $ 9,750 $ 2,925
turbonmr
Viscoelasticity Viscoelasticity: Estimates the Dynamical mechanical $ 13,000 $ 6,500 $ 1,950
viscoelas response of dilute polymer solutions.Requires Insight II.
X-AutoFit X-AutoFit: Chain tracing and model building for protein $ 29,900 $ 14,950 $ 4,485
xautofit crystallography. Requires QUANTA. X-Build recommended.
Host-locked license.
X-AutoFit/X-Build X-AutoFit/X-Build bundle: $ 53,300 $ 26,650 $ 7,995
xautofitxbuild
X-AutoFit/X-Build/X- X-AutoFit/X-Build/X-Ligand bundle: $ 76,700 $ 38,350 $11,505
xautofitxbuildxligand
X-AutoFit/X-Ligand X-AutoFit/X-Ligand bundle: $ 53,300 $ 26,650 $ 7,995
xautofitxligand
MSI Price List (10/96) expressed in dollars for sales in Korea Molecular Simulations Inc.
SOFTWARE DESCRITION COMMERCIAL GOVERNMENT ACADEMIC
------------------- ---------- ---------- --------
X-Build X-Build: Final model building, interface to X-PLOR. Requires $ 29,900 $ 14,950 $ 4,485
xbuild QUANTA, X-PLOR. Includes X-SOLVATE. Host-locked
license.
X-Build/X-Ligand X-Build/X-Ligand bundle: $ 53,300 $ 26,650 $ 7,995
xbuildxligand
X-Ligand X-Ligand: $ 29,900 $ 14,950 $ 4,485
xligand
X-PLOR Reference X-PLOR Reference $ 59 $ 59 $ 59
docxplor
X-PLOR X-PLOR: Software for x-ray and NMR structure determination $ 52,000 $ 26,000 $ 7,800
xplor and refinement. Host-locked license.
X-PLOR/DG X-PLOR/DG: Software for NMR structure determination $ 39,000 $ 19,500 $ 5,850
xplordg including distance geometry. Host-locked license.
X-PLOR/Refine X-PLOR/Refine: Software for refinement of x-ray structures. $ 39,000 $ 19,500 $ 5,850
xplorrefine Host-locked license.
X-Ray Structure X-Ray Structure Analysis User's Guide $ 46 $ 46 $ 46
docqxray
XSight XSight: Comprehensive system for protein crystallography. $ 78,000 $ 39,000 $ 11,700
xsight
Zindo User Guide XSIGHT User Guide $ 98 $ 98 $ 98
docxsight
Xtal View Xtal View: Phasing and model fitting. $ 39,000 $ 19,500 $ 5,850
xtalview
XtalView User Guide XtalView User Guide $ 65 $ 65 $ 65
docxtalview
Zindo Zindo: $ 32,500 $ 16,250 $ 4,875
zindo
Zindo User Guide Zindo User Guide $ 59 $ 59 $ 59
doczindo
MSI Price List (10/96) expressed in dollars for sales in Korea Molecular Simulations Inc.
SOFTWARE DESCRIPTION COMMERCIAL GOVERNMENT ACADEMIC
--------------------- ---------- ---------- ---------
Affinity Affinity: Flexibly and automatically docks potential ligands $ 12,000 $ 6,000 $ 1,800
affinity into an active site. Requires Insight II and Discover.
Affinity User Guide Affinity User Guide $ 54 $ 54 $ 54
docaffinity
Amorphous Cell Amorphous Cell: Construction and Analysis tools for $ 24,000 $ 12,000 $ 3,600
amorphcell amorphous bulk polymers and interfacial phenomena.
Requires Insight II.
Apex-3D Apex-3D: Requires Insight II. $ 48,000 $ 24,000 $ 7,200
apex3d
Apex-3D User Guide Apex-3D User Guide $ 60 $ 60 $ 60
docapex3d
AXXESS (1 user) Axxess: X-terminal access to Insight II. Prices are per $ 6,600 $ 3,300 $ 990
axxess01 license. Requires Insight II to be licensed on the host
workstation. Annual license.
AXXESS (2-5 user) Axxess: X-terminal access to Insight II. Prices are per $ 4,950 $2,475.60 $742.80
axxess02 license. Requires Insight II to be licensed on the host
workstation. Annual license.
AXXESS (6+ user) Axxess: X-terminal access to Insight II. Prices are per $ 4,140 $ 2,070 $621.60
axxess06 license. Requires Insight II to be licensed on the host
workstation. Annual license.
Biopolymer Biopolymer: Requires Insight II. $ 15,000 $ 7,500 $ 2,250
biopolymer
Brookhaven Protein Brookhaven Protein Databank: Database of protein crystal $ 1,200 $ 1,200 $ 1,200
bnlpdb01 and NMR structures from BNL. One copy. Annual license.
Brookhaven Protein Brookhaven Protein Databank: Database of protein crystal $ 2,160 $ 2,160 $ 2,160
bnlpdb02 and NMR structures from BNL. Two updates. Annual
license.
Brookhaven Protein Brookhaven Protein Databank: Database of protein crystal $ 4,080 $ 4,080 $ 4,080
bnlpdb04 and NMR structures from BNL. Four updates. Annual
license.
C2 1.5 New C2 1.5 New Features Supplement $ 90 $ 90 $ 90
docc215new
C2 1.6 New C2 1.6 New Features Supplement $ 90 $ 90 $ 90
docc216new
C2.ADF C2.ADF: Amsterdam Density Functional code. $ 27,000 $ 13,500 $ 4,050
c2adf Executable only. Floating license.
C2.ADF Interface C2.ADF Interface: Provides an interface to the Amsterdam $ 9,000 $ 4,500 $ 1,350
c2adfint Density Functional program. User interface only. Floating
license.
C2.Alignment C2.Alignment: Molecular similarity and superpositioning $ 6,000 $ 3,000 $ 900
c2alignment methods. Floating license.
C2.Amorphous C2.Amorphous Builder: Builds models of amorphous $ 6,000 $ 3,000 $ 900
c2amorphbldr polymers and polymer/solvent systems. Floating license.
C2.Analog Builder C2.Analog Builder: Builds a congeneric collection/library of $ 6,000 $ 3,000 $ 900
c2analogbldr chemical structures. Floating license.
C2.Blends C2.Blends: Predicts phase behavior and phase diagrams. $ 18,000 $ 9,000 $ 2,700
c2blends Requires ▇▇.▇▇▇. Floating license.
C2 Builders User C2 Builders User Reference $ 90 $ 90 $ 90
docc2builder
C2.CASTEP C2.CASTEP: A quantum mechanics code for materials $ 51,000 $ 25,500 $ 7,650
c2castep science, the solid state, and surfaces. Executable only.
Floating license.
MSI Price List (10/96) expressed in US dollars for sales in Asia/Pacific except Japan and Korea Molecular Simultations Inc.
SOFTWARE DESCRIPTION COMMERCIAL GOVERNMENT ACADEMIC
--------------------- ---------- ---------- ---------
C2.CASTEP C2.CASTEP Interface: Provdes an interface to the CASTEP $ 9,000 $ 4,500 $ 1,350
c2castepint program. Requires C2.Crystal Builder. C2.SurfaceBuilder
recommended. User interface only. Floating license.
C2.Conformers C2.Conformers: Provides conformational search algorithms $ 9,000 $ 4,500 $ 1,350
c2conformers and analysis tools for molecular structures. Requires
▇▇.▇▇▇. ▇▇.▇▇▇▇ recommended for Life Science
applications. Floating license.
C2.Crystal Builder C2.Crystal Builder: 3-D periodic crystal structure $ 6,000 $ 3,000 $ 900
c2crystalbldr construction and display. Floating license.
C2.▇▇▇▇▇▇▇ ▇▇▇▇▇▇ C2.▇▇▇▇▇▇▇ ▇▇▇▇▇▇: Minimizes the energy of molecular $ 6,000 $ 3,000 $ 900
c2crystalpckr crystals under full symmetry conditions. Requires
C2.Crystal Builder. Floating license.
C2.DB Access C2.DB Access: Provides access to Catalyst and MDL ISIS $ 6,000 $ 3,000 $ 900
c2dbaccess database searching programs. Requires Catalyst/Info or
MDL ISIS. Floating license.
C2.Descriptor+ C2.Descriptor+: Materials Science QSAR descriptors. $ 6,000 $ 3,000 $ 900
c2descriptor Requires C2.QSAR+. C2.Genetic Algorithms and
C2.Analog Builder recommended. Floating license.
C2.Descriptor+ C2.Descriptor+: Materials Science QSAR descriptors. $ 6,000 $ 3,000 $ 900
c2desc1 Requires C2.QSAR+. C2.Genetic Algorithms and
C2.Analog Builder recommended. Floating license.
C2 Diffraction and C2 Diffraction and Microscopy User's Reference $ 90 $ 90 $ 90
docc2diffmicro
C2.Diffraction-Amor C2.Diffraction-Amorphous: Simulates non-crystalline $ 12,000 $ 6,000 $ 1,800
c2diffamorph powder and fiber diffraction patterns and radial distribution
functions. Floating license.
C2.Diffraction-Cryst C2.Diffraction-Crystal: Simulates powder, fiber and single $ 12,000 $ 6,000 $ 1,800
c2diffcrystal crystal diffraction patterns. Requires C2.Crystal Builder.
Floating license.
C2.Diffraction-Fault C2.Diffraction-Faulted: Simulates powder diffraction from $ 9,000 $ 4,500 $ 1,350
c2difffault faulted or layered structures. Requires C2.Crystal Builder.
Floating license.
C2.Diversity C2.Diversity: Provides diversity/similarity selection $ 42,000 $ 21,000 $ 6,300
c2diversity techniques and topological/information descriptors for the
characterization of same. Requires C2.QSAR+. Floating
license.
C2.DLS C2.DLS: Predicts structures of inorganic framework crystals $ 9,000 $ 4,500 $ 1,350
c2dls using geometric refinement. Requires C2.Crystal Builder.
Floating license.
C2.Dynamics C2.Dynamics: Performs molecular dynamics simulations and $ 18,000 $ 9,000 $ 2,700
c2dynamics analysis. Requires ▇▇.▇▇▇. Floating license.
C2.EXAFS C2.EXAFS: Simulates, analyzes and refines EXAFS data. $ 24,000 $ 12,000 $ 3,600
c2exafs Includes EXCURVE code. Floating license.
C2.Force Field C2.Force Field Editor: Provides force field customization $ 6,000 $ 3,000 $ 900
c2ffeditor tools. Requires ▇▇.▇▇▇. Floating license.
C2.Gaussian C2.Gaussian Interface: Provides an interface to the $ 9,000 $ 4,500 $ 1,350
c2gaussian non-empirical Gaussian program. User interface only.
Floating license.
C2.Genetic C2.Genetic Algorithims: Genetic function approximation $ 6,000 $ 3,000 $ 900
c2geneticalgo applied to QSAR. Floating license.
MSI Price List (10/96) expressed in US dollars for sales in Asia/Pacific except Japan and Korea Molecular Simultations Inc.
SOFTWARE DESCRIPTION COMMERCIAL GOVERNMENT ACADEMIC
--------------------- ---------- ---------- ---------
C2.HRTEM C2.HRTEM: Simulates HRTEM images and dynamical $ 18,000 $ 9,000 $ 2,700
c2hrtem diffraction patterns in crystals, interfaces and defects.
Requires C2.Crystal Builder. Floating license.
C2 Hypothesis and C2 Hypothesis and Receptor Models User's Reference $ 90 $ 90 $ 90
docc2hyporec
C2 Installation and C2 Installation and Administration Guide $ 60 $ 60 $ 60
docc2install
C2.Interface Builder C2.Interface Builder: Definition and display of interfaces between $ 3,000 $ 1,500 $ 450
c2interfacebldr crystal structures. Requires C2.Crystal Builder.
Floating license.
C2.LEED/RHEED C2.LEED/RHEED: Simulates kinematic Low Energy and $ 9,000 $ 4,500 $ 1,350
c2leedrheed Reflection High Energy Electron Diffraction patterns.
Requires C2.Surface Builder. Floating license.
C2 Material Science C2 Material Science Tutorial Guide $ 90 $ 90 $ 90
docc2matsci
C2.Mechanical C2.Mechanical Properties: Predicts the mechanical behavior $ 12,000 $ 6,000 $ 1,800
c2mechprops of bulk materials. Requires C2.Crystal Builder, ▇▇.▇▇▇,
C2.Minimizer, C2.Dynamics. Floating license.
C2.MFA C2.MFA: Molecular field analysis for 3D QSAR. Requires $ 24,000 $ 12,000 $ 3,600
c2mfa ▇▇.▇▇▇, ▇▇.▇▇▇▇+, C2.FFEditor. Floating license.
C2.Minimizer C2.Minimizer: Performs energy minimization of molecular and $ 12,000 $ 6,000 $ 1,800
c2minimizer periodic structures. Requires ▇▇.▇▇▇. Floating license.
C2.MMFF C2.MMFF: Provides Merck Molecular Modeling Force Field for $ 12,000 $ 6,000 $ 1,800
c2mmff use with Drug Discovery applications. Requires ▇▇.▇▇▇.
Floating license.
C2 Modeling C2 Modeling Environment User's Reference $ 90 $ 90 $ 90
docc2modenv
C2.MOPAC C2.MOPAC Interface: Provides an interface to the $ 6,000 $ 3,000 $ 900
c2mopac semi-empirical MOPAC program. Includes MOPAC 6.0.
Floating license.
C2.Morphology C2.Morphology: Predicts and analyzes crystal morphology $ 18,000 $ 9,000 $ 2,700
c2morphology from internal crystal structure. Requires C2.Crystal Builder,
▇▇.▇▇▇. Floating license.
▇▇.▇▇▇▇ Force Field ▇▇.▇▇▇▇ Force Field: Open force field includes library of $ 12,000 $ 6,000 $ 1,800
c2off standard materials force fields. Includes Dreiding, Universal,
and other force fields. Floating license.
C2.Polymer Builder C2.Polymer Builder: Construction of polymer chains. $ 6,000 $ 3,000 $ 900
c2polymerbldr Includes monomer libraries. Floating license.
C2.Polymer C2.Polymer Properties: Calculates polymer physical $ 12,000 $ 6,000 $ 1,800
c2polyprops properties and structure. Floating license.
C2.Polymorph C2.Polymorph: Predicts polymorphs of organic molecules. $ 90,000 $ 90,000 $ 90,000
c2polymorph Requires C2.Crystal Builder, ▇▇.▇▇▇. Floating license.
C2.Powder Indexing C2.Powder Indexing: Allows powder diffraction patterns to be $ 6,000 $ 3,000 $ 900
c2powderindx indexed. Includes TREOR code. Floating license.
C2 Property C2 Property Prediction User's Reference $ 90 $ 90 $ 90
docc2proppred
C2.QSAR+ C2.QSAR+: Comprehensive toolkit for 2D and 3D QSAR. $ 24,000 $ 12,000 $ 3,600
c2qsar Floating license.
C2 QSAR+ User's C2 QSAR+ User's Reference $ 90 $ 90 $ 90
docc2qsar
MSI Price List (10/96) expressed in US dollars for sales in Asia/Pacific except Japan and Korea Molecular Simultations Inc.
SOFTWERE DESCRIPTION COMMERCIAL GOVERNMENT ACADEMIC
-------------------- ---------- ---------- --------
C2 Quantum C2 Quantum Mechanics Workbench User's Reference $ 90 $ 90 $ 90
docc2qmw
C2.Receptor C2.Receptor: Toolkit for creation and evaluation of $ 12,000 $ 6,000 $ 1,800
c2receptor pseudo-receptor models. Floating license.
C2.Rietveld C2.Rietveld: Performs crystal structure refinement and $ 18,000 $ 9,000 $ 2,700
c2rietveld quantitative phase analysis using DBWS or GSAS. Requires
C2.Crystal Builder. Includes DBWS code. Floating license.
C2.SDK C2.SDK Programmer's Guide $ 90 $ 90 $ 90
docc2sdkprog
C2.SDK-3rd party C2.SDK: Refer all third party opportunities directly to New N/A N/A N/A
c2sdk3rdparty Business Development (▇▇▇▇ ▇▇▇▇▇ Santi).
C2.SDK-internal first C2.SDK: Software Developers Kit. Requires C2.Visualizer. N/A $ N/A 9,600
c2sdkfacds Multi-user SDK license for an academic resaearch group.
Includes full support for one designated user.
C2.SDK-internal first C2.SDK: Software Developers Kit. Requires C2.Visualizer. N/A $ N/A 6,000
c2sdkfac Multi-user SDK license for an academic resaearch group.
Support not included.
C2.SDK-internal first C2.SDK: Software Developers Kit. Requires C2.Visualizer. N/A $ N/A 3,600
c2sdkres Multi-user SDK license for an academic research group.
Support not included. Additional licenses priced at $500
each.
C2.SDK-internal C2.SDK: Software Developers Kit. Requires C2.Visualizer. $ 3,600 $ 3,600 N/A
c2skdintadd Support limited to two named users at site (one for academic);
training not included in price. Price per additional license.
C2.SDK-internal first C2.SDK: Software Developers Kit. Requires C2.Visualizer. $ 48,000 $ 48,000 N/A
c2skdintfirst Support limited to two named users at site (one for academic);
training not included in price.
C2 Simulation Tools C2 Simulation Tools User's Reference $ 90 $ 90 $ 90
docc2simtool
C2.Sorption C2.Sorption: Predicts adsorption properties of microporous $ 18,000 $ 9,000 $ 2,700
c2sorption materials. Requires C2.Crystal Builder, ▇▇.▇▇▇. Floating
license.
C2.Super ADF C2.Super ADF: Amsterdam Density Functional code for $ 81,000 $ 40,500 $ 12,150
c2superadf supercomputers. Executable only. Host-locked license.
C2.Super CASTEP C2.CASTEP: A quantum mechanics code for materials $153,000 $ 76,500 $ 22,950
c2supercastep science, the solid state, and surfaces. Executable only.
Host-locked license.
C2.Surface Builder C2.Surface Builder: Surface chemistry 2-D periodic model $ 3,000 $ 1,500 $ 450
c2surfacebldr builder. Requires C2.Crystal Builder. Floating license.
C2 Using Command C2 Using Command Scripts $ 60 $ 60 $ 60
docc2command
C2.Visualizer C2.Visualizer: Comprehensive chemical computing $ 6,000 $ 6,000 $ 900
c2visualizer environment. Required core product. Floating license.
C2.X-GEN C2.X-GEN: Integrated package for the processing and $ 18,000 $ 9,000 $ 2,700
c2xgen reduction of diffraction data from area detectors. Requires
C2.Visualizer. Floating license.
Catalysis User Catalysis User Guide $ 60 $ 60 $ 60
doccatalysis
MSI Price List (10/96) expressed in US dollars for sales in Asia/Pacific except Japan and Korea Molecular Simulations Inc.
SOFTWERE DESCRIPTION COMMERCIAL GOVERNMENT ACADEMIC
-------------------- ---------- ---------- --------
Catalysis and Catalysis/Sorption Consortium: Customers must purchase $252,000 $ 0 N/A
conscatsorp licenses for Insight II, Discover, Solids Builder, Sorption,
Solids Docking, and Reaction Patterns for $60,000. Members
receive 3 copies of all software developed during Phase II.
Catalyst Installation Guide and Release Notes $ 30 $ 30 $ 30
doccatinstall
Catalyst Tutorials $ 54 $ 54 $ 54
doccattutorial
Catalyst/ACD Catalyst/ACD: Available Chemicals Directory. Requires $ 12,000 $ 12,000 $ 12,000
catacd01 Catalyst/Info. Annual License.
Catalyst/ACD (2-10 Catalyst/ACD: Available Chemicals Directory. Requires $ 22,800 $ 22,800 $ 22,800
catacd02 Catalyst/Info. Annual License.
Catalyst/ACD Catalyst/ACD: Available Chemicals Directory. Requires $ 30,000 $ 30,000 $ 30,000
catacd11 Catalyst/Info. Annual License.
Catalyst/BioByte Catalyst/BioByte Master File: 25,000 small molecules, $ 8,400 $ 8,400 $ 8,400
catbiobyte Pomona College Medicinal Chemistry. Requires
Catalyst/Info. Annual license.
Catalyst/View Catalyst/Compare: Provides query-query, $ 26,400 $ 13,200 $ 3,960
catcompare compound-compound, and query-compound comparision and
overaly functionality. Floating License.
Catalyst/DB Server Catalyst/DB Server: Database server for Catalyst. Requires $ 16,800 $ 8,400 $ 2,520
catdbserver Catalyst/View. Floating license.
Catalyst/Derwent's Catalyst/Derwent: Catalog of 40,000 compounds and $ 32,400 $ 32,400 $ 32,400
carderwent11 descriptive data. Requires Catalyst/Info. Annual license.
Catalyst/Derwent Catalyst/Derwent: Catalog of 40,000 compounds and $ 18,000 $ 18,000 $ 18,000
catderwent01 descriptive data. Requires Catalyst/Info. Annual license.
Catalyst/Derwent's Catalyst/Derwent: Catalog of 40,000 compounds and $ 27,000 $ 27,000 $ 27,000
catderwent02 descriptive data. Requires Catalyst/Info. Annual license.
Catalyst/Hypo Catalyst/Hypo: Allows additional simultaneous batch $ 50,400 $ 25,200 $ 7,560
cathypo hypothesis generation. Requires Catalyst/View. Floating
license.
Catalyst/Info Catalyst/Info: Integrated 1D, 2D, 3D chemical database $ 33,600 $ 16,800 $ 5,040
catinfo system. Requires Catalyst/View. Floating license.
Catalyst/Maybridge Catalyst/Maybridge: Catalog of 47,000 compounds. Included $ 0 $ 0 $ 0
catmaybridge with Catalyst/Info. Annual license.
Catalyst/NCI Catalyst/NCI: National Cancer Institute database with 98,000 $ 0 $ 0 $ 0
catnci registered compounds. Included with Catalyst/Info. Annual
license.
Catalyst/Shape Catalyst/Shape: Performs multiconformation shape similarity $ 21,600 $ 10,800 $ 3,240
catshape searching. Calculates 3D shape descriptors for the
characterization of combinatorial libraries. Requires
Catalyst/View and Catalyst/DB Server. Catalyst/Info
recommended. Floating license.
Catalyst/View Catalyst/View: Drug discovery environment for identifying $ 32,400 $ 32,400 $ 4,860
catview active, structurally diverse leads for both the medicinal
chemist and modeler. Floating license.
Catalyst/View Catalyst/Visualizer: Drug discover enviroment for $ 6,000 $ 6,000 $ 900
catvisualizer identifying active, structurally diverse leads for both the
medicinal chemist and modeler. Floating license.
CFF 95 CFF 95: Requires Discover. $ 18,000 $ 9,000 $ 2,700
cff95
MSI Price List (10/96) expressed in US dollars for sales in Asia/Pacific except Japan and Korea Molecular Simulations Inc.
SOFTWERE DESCRIPTION COMMERCIAL GOVERNMENT ACADEMIC
-------------------- ---------- ---------- --------
Characterize Characterize: Base Module requirement for most analytical $ 3,600 $ 1,800 $ 540
characterize simulations in InsightII. Includes geometric analysis tools.
Part of Catalysis Consortium. Requires Insight II.
CHARMm Command CHARMm Command Dictionary Part One and Two $ 42 $ 42 $ 42
doccharmmdict
CHARMm CHARMm: Comprehensive force field and program for energy $ 46,800 $ 23,400 $ 7,020
charmm calculations. Includes extensive parameter library.
Host-locked license.
CHARMm Principles CHARMm Principles $ 60 $ 60 $ 60
doccharmmprin
CHARMm/MMFF CHARMm/MMFF: Merck Molecular force field option to $ 12,000 $ 6,000 $ 1,800
charmmmmff CHARMm. Includes extensive parameter library. Requires
QUANTA, CHARMm. Host-locked license.
CombiChem (1996 CombiChem Consortium: Customers must also purchase $102,000 $ 0 $ 0
conscombi licenses for C2 Drug Discovery software. Members receive
software licenses per agreement.
ConFirm ConFirm: Conformational model generator using ▇▇▇▇▇▇ to $ 24,000 $ 12,000 $ 3,600
confirm promote "coverage". Floating license.
ConFirm User's ConFirm User's Guide $ 60 $ 60 $ 60
docconfirm
Consensus Consensus: Requires Insight II and Homology. $ 21,600 $ 10,800 $ 3,240
consensus
Consensus User Consensus User Guide $ 54 $ 54 $ 54
docconsensus
Consulting (daily) $ 2,160 $ 2,160 $ 2,160
consulting
Converter Converter: Requires Insight II and Sketcher. $ 30,000 $ 15,000 $ 4,500
converter
Converter User Converter User Guide $ 36 $ 36 $ 36
docconverter
Crystal Cell Crystal Cell: Study Energetics of Crystalline polymer $ 12,000 $ 6,000 $ 1,800
crystalcell systems. Requires Insight II.
DeCipher DeCipher: Requires Insight II, Analysis, and Discover. $ 12,000 $ 6,000 $ 1,800
decipher
DeCipher User DeCipher User Guide $ 42 $ 42 $ 42
docdecipher
DelPhi and DelPhi and Solvation User Guide $ 60 $ 60 $ 60
docdelphi
DelPhi DelPhi: Requires Insight II. $ 43,200 $ 21,600 $ 6,480
delphi
Diffraction Diffraction: X-ray and Electron single crystal and powder $ 12,000 $ 6,000 $ 1,800
diffraction Diffaction, Crystalline, Amorphous and Fiber diffraction.
Requires Insight II and Characterize.
DISCON/NOESYSI DISCON/NOESYSIM: Software for generating restraints $ 7,500 $ 3,750 $1,125.60
discon using relaxation matrix analysis. For use with NMR Structure
Determination. Host-locked license.
Discover (3 parts) Discover (3 parts) $ 90 $ 90 $ 90
docdiscover
MSI Price List (10/96) expressed in US dollars for sales in Asia/Pacific except Japan and Korea Molecular Simulations Inc.
SOFTWARE DESCRIPTION COMMERCIAL GOVERNMENT ACADEMIC
-------------------- ---------- ---------- ---------
Discover Discover: A molecular mechanics simulation environment $ 46,800 $ 23,400 $ 7,020
discover offering energy minimization, dynamics and Monte Carlo
techniques. Requires Insight II.
Dmol Dmol: Local Density Functional quantum mechanics code. $ 36,000 $ 18,000 $ 5,400
dmol molecular systems only. Symmetry supported.
InsightII Recommended
DMol User Guide DMol User Guide $ 60 $ 60 $ 60
docdmol
DSolid DSolid: Requires Insight II. $ 60,000 $ 30,000 $ 9,000
dsolid
EOM (1996 fee; EOM Consortium: Customers must also purchase licenses $168,000 $ 0 $ 0
conseom for Insight II, Discover, and Solids Builder for $40,000 and at
least one EOM code product for $45,000. Members receive
3 copies of all software developed during Phase II.
EOM-DSolid EOM-DSolid $ 60 $ 60 $ 60
docdsolid
EOM-ESOCS EOM-ESOCS $ 48 $ 48 $ 48
docesocs
EOM-Fast Stucture EOM-Fast Stucture $ 48 $ 48 $ 48
docfaststr
EOM-Plane Wave EOM-Plane Wave $ 48 $ 48 $ 48
docplanewave
ESOCS ESOCS: Requires Insight II. $ 60,000 $ 30,000 $ 9,000
esocs
EXAFS EXAFS: FEFF EXAFS scattering simulation. Requires Insight $ 6,000 $ 3,000 $ 900
exafs II and Characterize.
FastStruct/SimAnn FastStruct/SimAnn: Requires Insight II. $ 60,000 $ 30,000 $ 9,000
faststruct
▇▇▇▇▇ for Windows ▇▇▇▇▇ for Windows: $ 1,800 $ 1,800 $ 1,200
felixwin01
▇▇▇▇▇ for Windows ▇▇▇▇▇ for Windows: $ 6,000 $ 6,000 $ 3,990
felixwin05
▇▇▇▇▇ for Windows ▇▇▇▇▇ for Windows: $ 9,000 $ 9,000 $ 6,000
felixwin10
▇▇▇▇▇ for Windows ▇▇▇▇▇ for Windows: $ 18,000 $ 18,000 $ 12,000
felixwin25
▇▇▇▇▇ for Windows ▇▇▇▇▇ for Windows: Requires an existing license for ▇▇▇▇▇ $ 354 $ 354 $ 234
felixwinupgr01 for Windows.
▇▇▇▇▇ for Windows ▇▇▇▇▇ for Windows: Requires an existing license for ▇▇▇▇▇ $ 1,200 $ 1,200 $ 750
felixwinupgr10 for Windows.
▇▇▇▇▇ User Guide, ▇▇▇▇▇ User Guide, Tutorial, and Reference Guide $ 90 $ 90 $ 90
docfelix
▇▇▇▇▇-2D ▇▇▇▇▇-2D: $ 24,000 $ 12,000 $ 3,600
felix2d
▇▇▇▇▇-Assign ▇▇▇▇▇-Assign: Requires ▇▇▇▇▇-2D or ▇▇▇▇▇-ND. $ 36,000 $ 18,000 $ 5,400
felixassign
▇▇▇▇▇-Model ▇▇▇▇▇-Model: Requires ▇▇▇▇▇-2D or ▇▇▇▇▇-ND. $ 18,000 $ 9,000 $ 2,700
felixmodel
▇▇▇▇▇-ND ▇▇▇▇▇-ND: $ 36,000 $ 18,000 $ 5,400
felixnd
MSI Price List (10/96) expressed in US dollars for sales in Asia/Pacific except Japan and Korea Molecular Simultations Inc.
SOFTWARE DESCRIPTION COMMERCIAL GOVERNMENT ACADEMIC
-------------------- ---------- ---------- ---------
▇▇▇▇▇-X-Remote ▇▇▇▇▇-X-Remote: Requires any ▇▇▇▇▇. $ 6,000 $ 3,000 $ 900
felixxremote
File Formats File Formats Reference $ 48 $ 48 $ 48
docfileformats
Flexiblend Flexiblend: Requires Insight II and Discover. $ 12,000 $ 6,000 $ 1,800
flexiblend
HipHop HipHop: Feature-based alignment tool for 3D QSAR and 3D $ 24,000 $ 12,000 $ 3,600
hiphop search queries. Floating license.
HipHop User's Guide HipHop User's Guide $ 60 $ 60 $ 60
dochiphop
Homology Homology: Requires Insight II and Discover. $ 36,000 $ 18,000 $ 5,400
homology
Homology User Guide Homology User Guide $ 60 $ 60 $ 60
dochomology
Insight (2 parts) Insight (2 parts) $ 60 $ 60 $ 60
docinsight
Insight 300 Release Insight 300 Release Documentation $ 24 $ 24 $ 24
docins300
Insight 950 Release Insight 950 Release Documentation $ 24 $ 24 $ 24
docins950
Insight AXXESS Insight AXXESS User Guide $ 42 $ 42 $ 42
docaxxess
Insight II 4.0.0 Release Documentation $ 24 $ 24 $ 24
docins400
Insight II 4.0.0 User's Guide $ 60 $ 60 $ 60
docins400user
Insight II Insight II: General chemical modeling envioronment with $ 15,000 $ 7,500 $ 2,250
insight customizable macro interface.
Interphases Interphases: Calculate statistical properties of mono and $ 12,000 $ 6,000 $ 1,800
interphases bilayers in a polyemeric interphase system. Requires Insight
II.
IR_Raman IR_Raman: Simulation and display of Infra-Red vibrational $ 6,000 $ 3,000 $ ▇▇▇
▇▇▇▇▇▇▇ spectra and normal mode analysis. Requires Insight II and
Characterize.
License Guide License Guide $ 30 $ 30 $ 30
doclicense
Ligand Design User Ligand Design User Guide $ 36 $ 36 $ 36
docligand
▇▇▇▇ ▇▇▇▇: Requires Insight II. $ 36,000 $ 18,000 $ 5,400
▇▇▇▇
▇▇▇▇/ACD Ludi/ACD: Requires Ludi. $ 12,000 $ 6,000 $ 3,600
ludiacd
MADSYS: Provides phasing for multiple anomalous $ 12,000 $ 6,000 $ 1,800
madsys dispersion data. Requires XSIGHT.
MCSS/Hook MCSS/HOOK: Receptor structure-based ligand design with $ 27,000 $ 13,500 $ 4,050
mcsshook database search. Requires QUANTA, CHARMm. Host-locked
license.
MCSS/Hook User's MCSS/Hook User's Guide $ 60 $ 60 $ 60
docmcsshook
MSI Price List (10/96) expressed in US dollars for sales in Asia/Pacific except Japan and Korea Molecular Simultations Inc.
SOFTWARE DESCRIPTION COMMERCIAL GOVERNMENT ACADEMIC
-------------------- ---------- ---------- ---------
Miscibility Miscibility: Requires Insight II, Phase Diagram, Flexiblend, $ 12,000 $ 6,000 $ 1,800
miscibility and ▇▇▇▇▇▇▇.
Modeler Modeler (for Insight II): Provides automated homology $ 27,600 $ 13,800 $ 4,140
insmodeler modeling. Requires Insight II and Homology. Host-locked
license.
Modeler Modeler (for QUANTA): Provides automated homology $ 27,600 $ 13,800 $ 4,140
modeler modeling. Requires QUANTA. Host-locked license.
Morphology Morphology: Predicts and analyzes crystal morphology from $ 6,000 $ 3,000 $ 900
morphology internal crystal structure. Requires InsightII, Solids_Builder,
and Characterize.
Networks Networks: Monte Carlo technique for study network formation $ 12,000 $ 6,000 $ 1,800
networks and cross-linking. Requires Insight II.
NMR Compass NMR.Compass: Software for computer aided assignment and $ 30,000 $ 15,000 $ 4,500
nmrcompass analysis of multidimensional data. QUANTA recommended.
Host-locked license.
NMR.Compass User NMR.Compass User Guide $ 90 $ 90 $ 90
docnmrcompass
NMR Pipe NMR.Pipe: Software for multidimensional NMR spectral $ 36,000 $ 18,000 $ 5,400
nmrpipe processing. Stand-alone executable only; no integration with
NMR.Compass. Host-locked license.
NMR.Pipe User's NMR.Pipe User's Guide $ 30 $ 30 $ 30
docnmrpipe
NMR Refine NMR Refine Advance: Requires Insight II and Discover. $ 48,000 $ 24,000 $ 7,200
nmrrefineadv
NMR Refine NMR Refine Complete: Includes NMR Refine Advance and $ 72,000 $ 36,000 $ 10,800
nmrrefinecom NMR Refine DG. Requires Insight II and Discover.
NMR Refine DGII NMR Refine DGII: Requires Insight II. $ 36,000 $ 18,000 $ 5,400
nmrrefinedg
NMR Structure NMR Structure Determination: Software for structure $ 27,600 $ 13,800 $ 4,140
nmrstructure generation and strucuture analysis/evaluation. Requires
QUANTA. Host-locked license.
NMRchitect User NMRchitect User Guide $ 60 $ 60 $ 60
docnmrchitect
Open Interface Open Interface Programmer Guide $ 60 $ 60 $ 60
docopenint
Open Interface Open Interface: Requires Insight II. Annual license pricing $ 6,000 $ 6,000 $ 900
openint ($3333 license fee, $1667 maintenance fee).
PEFC Associate PEFC Associate Membership: Non-voting membership. $ 6,000 $ 3,000 $ 900
conspefcasso2 1 force field seat. No consortium software or databases.
No workshop attendance. Limited suppport. Not available for
new memberships. Price per year after first year.
PEFC Executive PEFC Executive Membership: Voting membership. 8 force $ 54,000 $ 27,000 $ 8,100
conspefcexec1 field seats. Site license for consortium software and
databases. Workshop attendance available at additional cost.
Support included. Price per year, 3 year commitment.
PEFC Executive PEFC Executive Membership: Voting membership. 8 force $ 30,000 $ 15,000 $ 4,500
conspefcexec2 field seats. Site license for consortium software and
databases. Workshop attendance available at additional cost.
Support included. Price per year after first 3 years.
MSI Price List (10/96) expressed in US dollars for sales in Asia/Pacific except Japan and Korea Molecular Simultations Inc.
SOFTWARE DESCRIPTION COMMERCIAL GOVERNMENT ACADEMIC
-------------------- ---------- ---------- --------
PEFC Standard PEFC Standard Membership: Non-voting membership. 3 force $ 24,000 $ 0 $ 0
conspefcstd field seats. 1 workstation license for consortium software and
databases. Workshop attendance available at additional cost.
Support included. Price per year, 3 year commitment.
Phase Diagram Phase Diagram: Calculate liquid-liquid phase diagrams for $ 12,000 $ 6,000 $ 1,800
phasediagram polymer solutions and blends. Requires Insight II.
Plane Wave Plane Wave: Requires Insight II. $ 60,000 $ 30,000 $ 9,000
planewave
Polymer (3 parts) Polymer (3 parts) $ 120 $ 120 $ 120
docpolymer
Polymer (1-year: Polymer Consortium: No products included in corsortium $108,000 $ 0 $ 0
conspolymer01 price. Customers advised to purchase licenses for Insight II,
Discover, and a variety of Polymer modules.
Polymer (3-year: Polymer Consortium: No products included in corsortium $ 84,000 $ 0 $ 0
conspolymer03 price. Customers advised to purchase licenses for Insight II,
Discover, and a variety of Polymer modules. Price is per year.
Polymerizer Polymerizer: Construction of polymer chains, Including $ 9,000 $ 4,500 $ 1,350
polymerizer monomer libraries. Requires InsightII.
PolyNMR PolyNMR: Predicts NMR spectra for polymer chains. $ 12,000 $ 6,000 $ 1,800
polynmr Requires Insight II and RIS.
PRISM PRISM: Predicts polymer blends miscibility based on $ 12,000 $ 6,000 $ 1,800
prism chemical composition. Requires Insight II.
Profiles 3D User Profiles 3D User Guide $ 54 $ 54 $ 54
docprofiles3d
Profiles-3D Profiles-3D: Requires Insight II. $ 21,000 $ 10,500 $ 3,150
profiles3d
Protein Health Protein Health: Provides identification of structural anomalies. $ 12,000 $ 6,000 $ 1,800
health Requires QUANTA. Host-locked license.
Protein Modeling Protein Modeling: System for homology and structural $ 36,000 $ 18,000 $ 5,400
protein analysis of proteins. Requires QUANTA. Includes Protein
Design and Protein Health. Host-locked license.
QSPR QSPR: Quantitative Structure Property Relationships predicts $ 12,000 $ 6,000 $ 1,800
qspr properties for a wide range of thermoplastic materials.
Requires Insight II.
QUANTA 4.1 New QUANTA 4.1 New Features Supplement $ 60 $ 60 $ 60
docq41new
QUANTA Basic QUANTA Basic Operations $ 42 $ 42 $ 42
docqbasicops
QUANTA core QUANTA core: Complete molecular modeling environment. $ 24,000 $ 12,000 $ 3,600
quanta CHARMm strongly recommended. Host-locked license.
QUANTA QUANTA Generating and Displaying Molecules $ 42 $ 42 $ 42
docqgendisp
QUANTA NMR QUANTA NMR Structure Determination User's Guide $ 42 $ 42 $ 42
docqnmrstr
QUANTA Protein QUANTA Protein Homology Modeling Tutorial $ 42 $ 42 $ 42
docqhomology
QUANTA Protein QUANTA Protein User's Reference $ 42 $ 42 $ 42
docqprotein
MSI Price List (10/96) expressed in US dollars for sales in Asia/Pacific except Japan and Korea Molecular Simulations Inc.
SOFTWARE DESCRIPTION COMMERCIAL GOVERNMENT ACADEMIC
-------------------- ---------- ---------- --------
QUANTA QUANTA Simulation, Search, and Analysis $ 42 $ 42 $ 42
docqsimsearch
QUANTA96 New Features Supplement $ 60 $ 60 $ 60
docq96new
QuanteMM QuanteMM $ 60 $ 60 $ 60
docquantemm
QuanteMM QuanteMM: Hybrid QM/MM technique for optimizing large $ 18,000 $ 9,000 $ 2,700
quantemm or periodic structures. Can use Mopac, Dmol or Turbomole as
QM engine. Requires Insight II and Discover
Reaction Patterns Reaction Patterns: Reaction engineering toolkit. $ 12,000 $ 6,000 $ 1,800
reactpatterns Complimentary tools for evaluation reaction trends. Requires
Insight II.
RIS RIS: Calculate conformational properties of polymer chains. $ 12,000 $ 6,000 $ 1,800
ris Requires Insight II.
Search/Compare Search/Compare: Requires Insight II. $ 24,000 $ 12,000 $ 3,600
searchcomp
Search Compar Search Compar User Guide $ 60 $ 60 $ 60
docsearchcomp
Sketcher Sketcher: 2-D sketcher with ▇▇▇▇ ▇▇▇▇▇▇▇▇-geometry 3D $ 3,000 $ 1,500 $ 450
sketcher converter.
Solids Builder Solids Builder: Crystal Building 3-D periodic structures, 2-D $ 18,000 $ 9,000 $ 2,700
solidsbldr Surfaces and Interfaces. Requires Insight II. Includes Solids
Adjustment.
Solids Diffusion: Studies the behavior of molecules iwthin $ 12,000 $ 6,000 $ 1,800
solidsdiffusion microporous host materials. Requires Insight II, Discover.
Solids Docking Solids Docking: Highly automated procedures for investigation $ 18,000 $ 9,000 $ 2,700
solidsdocking of interactions of molecules with surfaces and porous
materials. Requires Insight II and Solids Builder and Discover.
Solids Simulation Solids Simulation: Lattice Minimization and Dynamics for $ 12,000 $ 6,000 $ 1,800
solidssimul Inorganic systems including Melt-Quench protocols for
creating silicate glasses. Requires Insight II.
Solids-NMR Solids-NMR: Predicts Si29 Solid State NMR pattern for $ 6,000 $ 3,000 $ 900
solidsnmr Zeolites. Should rtecommend TurboNMR for higher degree of
accuracy. Requires Insight II and Characterize.
Sorption Sorption: Requires Insight II, Solids Builder. $ 18,000 $ 9,000 $ 2,700
sorption
Structure Image Structure Image: Simulates HRTEM images and dynamical $ 12,000 $ 6,000 $ 1,800
structimage diffraction patterns in crystals, interfaces, layered materials
and defects. Requires InsightII.Solids_Builder.
Structure Refine Structure Refine: Interactive Reitveld refinement of Crystal $ 12,000 $ 6,000 $ 1,800
structrefine Structures through GSAS interface. Part of Catalysis
Consortium. Requires Insight II.
Structure Solve Structure Solve: Simulated Annealing tools for solving $ 12,000 $ 6,000 $ 1,800
structsolve structures of organic and inorganic materials. Part of
Catalysis Consortium. Requires Insight II and Solids
Simulation.
Super CHARMm Super CHARMm: Comprehensive force field and program for $210,000 $ 105,000 $ 31,500
supercharmm energy calculations. Includes extensive parameter library.
Supercomputers only. Includes source code. Host-locked
license.
MSI Price List (10/96) expressed in US dollars for sales in Asia/Pacific except Japan and Korea Molecular Simulations Inc.
SOFTWARE DESCRIPTION COMMERCIAL GOVERNMENT ACADEMIC
-------------------- ---------- ---------- --------
Super Discover Super Discover: A molecular mechanics simulation $210,000 $ 105,000 $ 31,500
superdiscover environment offering energy minimization, dynamics and
Monte Carlo techniques. Supercomputers only. Host-locked license.
Super Dmol Super Dmol: Local Density Functional quantum mechanics $108,000 $ 54,000 $ 16,200
superdmol code. molecular systems only. Symmetry supported.
Supercomputer version. InsightII Recommended
Super X-PLOR Super X-PLOR: Software for refinement of x-ray structures for $240,000 $ 120,000 $ 36,000
superxplor Category 3 machines. Supercomputers only. Includes source
code. Host-locked license.
Super X-PLOR/DG Super X-PLOR/DG: Software for refinement of x-ray structures $198,000 $ 99,000 $ 29,700
superxplordg for supercomputers. Includes source code. Host-locked
license.
Super Super X-PLOR/Refine: Software for refinement of x-ray $198,000 $ 99,000 $ 29,700
superxplorref structures for supercomputers. Includes source code.
Host-locked license.
▇▇▇▇▇▇▇ ▇▇▇▇▇▇▇: Provides Rapide estimation of Many polymer $ 12,000 $ 6,000 $ 1,800
▇▇▇▇▇▇▇ properties. Requires Insight II.
System Guide System Guide $ 48 $ 48 $ 48
docsystguide
Token Guide Token Guide $ 42 $ 42 $ 42
doctoken
Training-1 Day Training: Installation, new customer orientation and $ 1,800 $ 1,800 $ 0
train 1 daycust demonstration. Customer pays travel costs.
Training-2 Day Training: On Site Customized Workshop with a maximum of $ 6,000 $ 4,800 $ 3,600
train2daycust 12 attendees. Customers provides machines and facility, MSI
provides instructor and materials.
Training-Workshop Training: Prepackaged Workshop Materials (5 copies) for $ 1,200 $ 1,200 $ 1,200
trainmaterials self-run workshops. Choose from 8 units.
Training-2 Day Training: Regional Workshops with 10-15 attendees including $ 1,200 $ 600 $ 480
train2daystd lecture and hands-on training. Price per attendee. Schedule
published on WWW.
Turbomole Turbomole: $ 33,000 $ 16,500 $ 4,950
turbomole
Turbomole User Turbomole User Guide $ 48 $ 48 $ 48
docturbomole
TurboNMR TurboNMR: Requires Insight II and Turbomole. $ 18,000 $ 9,000 $ 2,700
turbonmr
Viscoelasticity Viscoelasticity: Estimates the Dynamical mechanical $ 12,000 $ 6,000 $ 1,800
viscoelas response of dilute polymer solutions.Requires Insight II.
X-AutoFit X-AutoFit: Chain tracing and model building for protein $ 27,600 $ 13,800 $ 4,140
xautofit crystallography. Requires QUANTA. X-Build recommended.
Host-locked license.
X-AutoFit/X-Build X-AutoFit/X-Build bundle: $ 49,200 $ 24,600 $ 7,380
xautofitxbuild
X-AutoFit/X-Build/X- X-AutoFit/X-Build/X-Ligand bundle: $ 70,800 $ 35,400 $ 10,620
xautofitxbuildxligand
X-AutoFit/X-Ligand X-AutoFit/X-Ligand bundle: $ 49,200 $ 24,600 $ 7,380
xautofitxligand
MSI Price List (10/96) expressed in US dollars for sales in Asia/Pacific except Japan and Korea Molecular Simulations Inc.
SOFTWARE DESCRIPTION COMMERCIAL GOVERNMENT ACADEMIC
-------------------- ---------- ---------- --------
X-Build X-Build: Final model building, interface to X-PLOR. Requires $ 27,600 $ 13,800 $ 4,140
xbuild QUANTA, X-PLOR. Includes X-SOLVATE. Host-locked
license.
X-Build/X-Ligand X-Build/X-Ligand bundle: $ 49,200 $ 24,600 $ 7,380
xbuildxligand
X-Ligand X-Ligand: $ 27,600 $ 13,800 $ 4,140
xligand
X-PLOR Reference X-PLOR Reference $ 54 $ 54 $ 54
docxplor
X-PLOR X-PLOR: Software for x-ray and NMR structure determination $ 48,000 $ 24,000 $ 7,200
xplor and refinement. Host-locked license.
X-PLOR/DG X-PLOR/DG: Software for NMR structure determination $ 36,000 $ 18,000 $ 5,400
xplordg including distance geometry. Host-locked license.
X-PLOR/Refine X-PLOR/Refine: Software for refinement of x-ray structures. $ 36,000 $ 18,000 $ 5,400
xplorrefine Host-locked license.
X-Ray Structure X-Ray Structure Analysis User's Guide $ 42 $ 42 $ 42
docqxray
XSight XSight: Comprehensive system for protein crystallography. $ 72,000 $ 36,000 $ 10,800
xsight
Zindo User Guide XSIGHT User Guide $ 90 $ 90 $ 90
docxsight
Xtal View Xtal View: Phasing and model fitting. $ 36,000 $ 18,000 $ 5,400
xtalview
XtalView User Guide XtalView User Guide $ 60 $ 60 $ 60
docxtalview
Zindo Zindo: $ 30,000 $ 15,000 $ 4,500
zindo
Zindo User Guide Zindo User Guide $ 54 $ 54 $ 54
doczindo
MSI Price List (10/96) expressed in US dollars for sales in Asia/Pacific except Japan and Korea Molecular Simulations Inc.