Chemoinformatics
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CACTVS Toolkit v.3 3
This page links to free academic versions of the Cactvs Chemoinformatics Toolkit. The packages found here are for evaluation and use in research and education only. They are not legal for use in any commercial environment.
Screening Assistant 2 v.1.0 RC 1
This program is dedicated to store chemical information in a local or network-accessible MySQL database, and perform various analysis using simple and advanced chemoinformatics methods.
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Chemistry Development Kit 1.5.1 Dev v.v
Chemistry Development Kit is now developed by more than 40 developers all over the world and used in more than 10 different academic as well as industrial projects world wide.
Ambit - chemical structures database v.2.2.4.5
AMBIT offers chemoinformatics functionality via REST web services and desktop applications.
Frowns v.0.8
Frowns is a chemoinformatics system written almost entirely in python.
Mychem v.0.9.1
Mychem is a chemoinformatics extension for MySQL.
PerlMol v.0.47
PerlMol is a collection of Perl modules for chemoinformatics and computational chemistry with the philosophy that "simple things should be simple".