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BAC is a tool for molecular dynamics binding affinity calculations.

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# radical.ensemblemd.mdkernels

A thin wrapper around common molecular dynamics engines, like AMBER, NAMD, GROMACS, etc.

0.1 Initial Version June 04. 2014

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0.2

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0.1

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radical.ensemblemd.mdkernels-0.2.tar.gz (8.4 kB) Copy SHA256 hash SHA256 Source None May 20, 2015

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