We here present a novel computer algorithm, called AutoClickChem, capable of performing many click-chemistry reactions in silico. In silico modeling of click-chemistry products may prove useful in rational drug design and drug optimization.

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Categories

Chemistry, Bio-Informatics, Molecular Mechanics

License

GNU General Public License version 2.0 (GPLv2)

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  • tfileme Posted 2013-05-21
    Autoclickchem works good.
    1 user found this review helpful.
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Additional Project Details

Languages

English

Intended Audience

Science/Research

User Interface

Command-line

Programming Language

Python

Related Categories

Python Chemistry Software, Python Bio-Informatics Software, Python Molecular Mechanics Software

Registered

2011-06-12
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