Chemistry Software

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Physical and Theoretical
- Gamess
- GAMESS-UK
- MOMix and ALP-Vibro
- Jaguar
- GaussSum
- Spectra
- MOLCAS
- ArgusLab
- YAeHMOP
- CASTEP - CAmbridge Serial Total En...
- Atoms in Molecules (AIM2000)
- MPQC
- Extensible Computational Chemistry...
- Moloc
- ORCA
- Banned By Gaussian
- CHEAQS
- AOMix
- PyQuante
- Thermodynamic Modeling
- WinMopac
- Motofit
- CHEMKED
- Zeta Potential
- Zori
- Environment-Dependent Interatomic ...
- CRYSTAL Home Page
- CHEMKIN Collection Software
- CONFLEX2000
- WebMO
- SHB_interactions
- ADF


Structural Drawing
- Chemical Drawing Programs Review
- Chemtool
- JChemPaint
- WinDrawChem/XDrawChem
- ChemicPen
- EasyChem
- BKchem
- ChemWindow
- XymTex
- JME
- ChemInnovation Software
- Gifcreator
- JMolDraw
- PLT
- BKchem

Structural Visualization
- Viewmol
- ChemCraft
- OpenScience
- VMD
- Protein Explorer
- Facio
- GOpenMol
- MOLMOL
- MOLDEN
- Swiss-PdbViewer
- RasMol
- PovChem
- SweetMollyGrace
- Ymol
- UCSF Chimera
- Santorini and Patmos, Molecular Vi...
- PyMolWiki
- PyMOL
- Grasp
- DTMM
- CueMol
- Brabosphere
- Biodesigner and iMol
- JIMP - The Interactive Molecule Pr...
- ProteinScope
- OpenRasMol
- Nanotube Modeler
- Molymod Molecular Models
- Historical Molecular Graphics
- Molda

Structural Visualization (part 2)
- Molcular Model Kits
- Labquip
- Jmol

Educational
- ChemTutor
- ScienceSoft
- OrChem
- Chemistry Software and Science Tea...
- CHEMIX
- The Physical Science Series
- Chemed.net
- Model Science Software
- Molecular Conceptor
- Lab Check Laboratory Grading Program
- High School Chemistry Software and...
- Formula Master
- Electronic Homework Systems, Inc.
- Cyber Ed
- Chemware
- Chemory
- CheMentor
- Polar
- Polychem
- Survey of Chemistry
- Chem1 Concept Builder
- Chem-It
- Academy Savant

Database
- SilverPlatter Information, Inc.
- Introductory Guide to Chemical Da...
- ChemStor
- CHEMPAK
- CHED
- ChemBase
- Chemical Information System (CIS)
- CHEMATIX
- Chemical Inventory System
- Chemoventory
- Data Aspects Corp

Development
- JOELib
- JChem
- Jumbo
- Pdb2vrml
- The Chemistry Development Kit
- Software Development Lohninger
- PerlMol
- Open Babel
- Frowns
- CACTVS System

Periodic Table
- ChemAP 2003
- Atomic Mac
- Atomic PC
- BK Periodic Library
- Celeste
- Synergy Creations
- Periodic Spiral of the Elements
- Kalzium
- Electronic Periodic Table of the E...
- Dhaatu Periodic Table
- ChemAP 2000

Cheminformatics
- Virtual Computational Chemistry La...
- MayaChemTools
- Cheminformatics.org
- Molinspiration Cheminformatics
- Ilib diverse
- ID Business Solutions
- Advanced Pharma Algorithms
- Bioreason

Companies
- CrystalMaker Software
- Axiom Discovery, Inc.
- Tripos, Inc
- Wavefunction, Inc
- MDL Information Systems
- Molfunction - Institute of Molecul...
- ChemSW
- Chemistry-Software.com
- Chemical Simulations Group
- Chemical Computing Group (CCG)
- ChemAxon
- CHEMAPPS
- CambridgeSoft
- Atomistix
- Advanced Chemistry Development
- Accelrys, Inc
- CompuChem
- Daylight Chemical Information Systems
- Molecular Networks GmbH
- Molecular Discovery Ltd.
- Metaphorics, LLC.
- MEDIT - Molecular Extended Distrib...
- Hypercube, Inc
- GNova Scientific Software
- Gaussian, Inc
- FQS Poland
- Eidogen-Sertanty

Companies (part 2)
- Desert Scientific Software
- MolMo Services: a Molecular Modeli...
- Synthematix
- Semichem, Inc.
- Scientific Instrument Services
- Schrödinger, Inc
- QuantumBio
- Q-Chem, Inc.
- Princeton Simulations
- Parallel Quantum Solutions
- OpenEye Scientific Software
- Molsoft L.L.C.

Calculation
- Chemistry Functions
- Physicochemical Calculators
- Reagent Calculator
- ChemBuddy
- Visual MINTEQ
- Norgwyn Montgomery Software
- MS Tools
- Laborant Chemstation
- JFormula
- Isotope Pattern Calculator v2.0
- Elem
- Chemical Calculator
- Chemical Calculator

Directories
- QSAR Software
- Linux4Chemistry
- Toms Free Chemistry Software Reference
- The OpenScience Project: Chemistry
- Scientific Applications for Linux:...
- Computational Chemistry List - Sof...
- Chemistry Software for Apple Macintosh
- Chemical Informatics Letters

Materials Chemistry
- Materials Explorer
- MTDATA - Thermodynamics and Phase ...
- Ceramic Chemistry and Database Sof...
- Triton Technology Time Temperature...
- Thermal Analysis Software
- ESM Software Software for Material...
- DTW Associates, Inc.

Web Publishing
- Chime
- VRML in Chemistry
- VRML File Creator for Chemical Str...
- SGML/XML at OASIS
- JavaScript Periodic Table by Tim H...
- GIF/PNG-Creator for 2D Plots of Ch...
- Clip Art from Bio-Rad/Sadtler
- PDB to MultiGif
- Marvin Applets and JavaBeans
- Linux for Chemistry CD-ROM Project

Structural
- Hyleos ChemFileBrowser and ChemView
- Marvin
- Mol2Mol
- Molecule for Macintosh
- MOLGEN

Calculation Equation Balancing
- ChemBalance
- Chemical Equation Expert
- Chemical Equations
- Chemos Software - BALANCER


Calculation Molecular Mass
- Molecular Weight Calculator
- Molecular Weight Calculation
- Molecular weight and elemental ana...
- Mole Calc
- McDalton
- Formol
- ChemCalc