Molecular Modeling Software

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ChemSW

• Molecular Modeling Pro
• Windows
• $199 academic price

• ChemSite molecular modeling and dynamics
• Windows
• $99 academic price, one user

Gaussian, Inc.

• Gaussian 03 and 03W
• Many platforms for Gaussian 03; 03W is for Windows
• $750 academic price for03W on a single computer; site licenses available
• Examples of pedagogical applications

Hypercube, Inc.

• Hyperchem Lite is a limited version of the more powerful Hyperchem
• Windows
• $69
• Molecular modeling, including quantum mechanics, molecular mechanics, and molecular dynamics

• Pocket HyperChem for pocket computers
• Windows CE
• $99

• Hyperchem Professional is a powerful and versatile molecular modeling package for research in organic and bio-chemistry, and crystallography
• Windows
• Academic price $1500 annual licence for small college

• Student Edition Hyperchem is available only to students
• Windows
• $89
• This version has all of the capability of the professional version, except that the number of atoms is limited

New River Kinematics, Inc.

• MoluCAD
• Windows and Macintosh
• $69.95; student individual price $19.95
• A molecular modeling and visualization tool for Mac and Windows users

Schrödinger

• Jaguar for Chem3D
• Windows or Linux
• Price by quote
• Ab initio package especially good for metal-containing systems

• MacroModel
• Linux or Windows
• Price by quote
• Force fields, solvation, conformational searching

• Maestro
• Linux or Windows
• Free download

Serena Software

• Pcmodel
• Windows, Linux, and Mac
• $400 academic price

Wavefunction, Inc.

• Spartan, PCSpartan, and MacSpartan
• Versions for PC, Mac, and Linux
• $4000/ten licenses of Spartan; SpartanModel $30/license
• Molecular modelling software