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An open source workbench for chemo- and bioinformatics built on the Eclipse Rich Client Platform (RCP).
Jmol is a Java molecular viewer for three-dimensional chemical structures. Features include reading a variety of file types and output from quantum ch...
The Chemistry Development Kit (CDK) is a Java library for bio- and chemoInformatics and computational chemistry. It is the basis of other projects lik...
Looking for a way to interpret the mass spectrometry (MS) data from your last proteomic experiment? Need to quantitate proteins in your ICAT/SILAC/iTR...
Open Babel is a community-driven scientific project including both cross-platform programs and developer library designed to support molecular modelin...
PyChem (http://pychem.org.uk) is a multivariate analysis package written in Python. It includes a front-end GUI allowing for storage and management of...
Collaborative Computing Project for NMR (CCPN)
APBS is a software package for the numerical solution of the Poisson-Boltzmann equation, a popular continuum model for describing electrostatic intera...
Pysces is the Python Simulator of Cellular Systems. For a network of coupled reactions it does a stoichiometric matrix analysis, calculates the time c...
JOELib/JOELib2 is a cheminformatics library which supports SMARTS substructure search, descriptor calculation, processing/filtering pipes, conversion ...