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alchemlyb Public
Forked from alchemistry/alchemlybthe simple alchemistry library
Python BSD 3-Clause "New" or "Revised" License UpdatedJun 4, 2024 -
plumed2 Public
Forked from plumed/plumed2Development version of plumed 2
C++ GNU Lesser General Public License v3.0 UpdatedFeb 22, 2022 -
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jupyter-minimal-mistakes Public
Action which turns Jupyter notebooks into Markdown posts to be used with the Minimal Mistakes Jekyll theme
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livecomsjournal.github.io Public
Forked from livecomsjournal/livecomsjournal.github.ioGitHub Pages site for the Living Journal of Computational Molecular Science
SCSS UpdatedFeb 27, 2021 -
gromacs Public
Forked from gromacs/gromacsPublic/backup repository of the GROMACS molecular simulation toolkit. Please do not mine the metadata blindly; we use Gerrit for code review and Redmine for issue tracking.
C++ Other UpdatedSep 15, 2020 -
2020-software-fellow-posters Public
Forked from MolSSI-Education/2020-software-fellow-postersJavaScript MIT License UpdatedJul 2, 2020 -
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gmxbenchmark Public
GROMACS benchmarking tool
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addition-shirts-groupmeeting Public
A simple repo demonstrating the use of Travis CI and Readthedocs for the Shirts group meeting
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