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Leonard Heinz
gromacs-rtc2018_modif

G

gromacs-rtc2018_modif

Project information

Modified version of GROMACS 2018.1rtc. The code was modified to apply the constraints to single atoms, to accommodate more index groups in the mdp file and to fix an issue with the number of degrees of freedom, calculated by grompp.

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BSD 2-Clause "Simplified" License
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Created on

May 14, 2019

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