Links
Chemoinformatics is an emerging field and many academic and industrial groups start to realize the power
of open source technology. In this section, we list up some of the valuable open source chemoinformatics
tools, open source content management systems, and open source information sources which with we
have experience with. We hope it might be of interest to you.
Blogs
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Chem-bla-ics -
delicious name for a delicious blog maintained by Egon Willighagen
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ChemConnector -
interesting blog site maintained by Antony Williams, the 'spider' behind ChemSpider
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Cheminformatics 2.0 -
blog by Alex Clarck about chemical information software for next generation computing
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Depth-First -
active blog by Rich Apodaca of Metamolecular
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Macs in Chemistry -
a brilliant collection of resources for chemists using Apple computers
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Noel O'Blog -
a well maintained blog from one of the core developers behind OpenBabel
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Peter Murray's blog -
the 'well-known' Peter Murray from the UCC for Molecular Informatics
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Rajarshi Guha's blog -
well-maintained blog focussing on several chemoinformatics aspects
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Blue Obelisk
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ChemoInformatics Dictionary -
dictionary of open source chemoinformatics algorithms
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Exchange -
the place to ask about almost everything stuff related to open chemical informatics
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Data analysis
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Knime -
a modular data exploration platform that enables the user to visually create data flows
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De novo design
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NewLead -
a splendid tool to build potentially bio-active molecules from pharmacophore models
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Graphics
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Bioclipse -
a free and open source workbench for the life sciences and drug discovery
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Chimera -
an extensible molecular modeling system for visualisation of macromolecules
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PyMol -
a powerful graphics system for visualisation of macromolecules
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Snippets
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CIRpy -
Python interface for the Chemical Identifier Resolver (CIR)
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Interactive plots 1 |
2 -
interactive plots for chemoinformatics
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