Quantum Chemistry


Quantum Chemistry Import Tool  v.0.3.1

Quantum Chemistry Import Tool is a django application that parses the output file of quantum chemistry software as NWChem, Octopus, Gaussian, etc.

Ascalaph Quantum  v.1.7.12

Ascalaph Quantum provides interfaces to ab initio quantum mechanical packages NWChem, CP2K and PC GAMESS/Firefly. A molecular viewer & model builder for quantum chemistry programs. It has an interface with NWChem,


ViewMol3D  v.4.22

A 3D OpenGL viewer for molecular structures from the output of quantum chemistry calculations.ViewMol3D uses Windows implementation of workstation-class OpenGL (OpenGL is a trademark of Silicon Graphics, Inc.

ChemCraft  v.1.6.348

Chemcraft is a graphical program for working with quantum chemistry computations. It is a convenient tool for visualization of computed results and preparing new jobs for the calculation.

GAMESS for Microsoft Windows 32-Bit  v.1.0

GAMESS is a General Atomic and Molecular Electronic Structure System written and maintaned by the Gordon research group a Iowa State University. GAMESS is a program for ab initio molecular quantum chemistry.

AIMAll (Version 09.11.08) for Windows  v.11. 10. 2016

AIMAll is an easy to use, accurate, reliable and efficient quantum chemistry software package for performing comprehensive, quantitative and visual QTAIM analyses of molecular systems - starting from molecular wave function data.

Jmol 12.3.4 Pre  v.1.0

Jmol is an applet and Java based application designed to display various 3D chemical information.

PyMOlyze  v.32

PyMOlyze is a graphical program to analyze the results of quantum chemistry (HF/DFT) calculations.

The CCP1GUI  v.0.8

The CCP1GUI project aims to develop a free, extensible Graphical User Interface to various computational chemistry codes developed by the worldwide academic community, with an emphasis on ab initio Quantum Chemistry codes.

Ascalaph Designer  v.1.8.44

Ascalaph Designer provides the methods to build and edit molecular models, geometry optimization, molecular dynamics simulations.Features: 1. Molecular graphics * Multiple windows * Two cameras per model * CPK, Wire frame, Stick, Ball and Stick and

U2WIN  v.2.02

U2WIN is a small, command prompt, can convet ASCII to Windows text files fast and easy, help you convert UNIX/Linux ASCII text files to MS-DOS/Windows-formatted text files.

INMR Reader  v.3.1.1

iNMR Reader has all the functionalities of the iNMR application with the same version number, but the user can't save the modified documents.

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