Topic: gromacswrapper Goto Github
Some thing interesting about gromacswrapper
Some thing interesting about gromacswrapper
gromacswrapper,GromacsWrapper wraps system calls to GROMACS tools into thin Python classes (GROMACS 4.6.5 - 2023 supported).
Organization: becksteinlab
Home Page: https://gromacswrapper.readthedocs.org
gromacswrapper,Legacy code from GromacsWrapper: gromacs.analysis module
Organization: becksteinlab
gromacswrapper,Calculation of water/solvent partition coefficients with Gromacs.
Organization: becksteinlab
Home Page: https://mdpow.readthedocs.io
gromacswrapper,Numerical first aid kit (with numpy/scipy).
Organization: becksteinlab
Home Page: https://numkit.readthedocs.io
gromacswrapper,All GROMACS/NAMD initializing files for generating initial structures for polydisperse chains with a set of residues desired by the user. With LigninBuilder, all lignin topologies can be built directly.
User: vaidyanathanms
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