Similar repositories to bforte/Alchemist:
bforte/Alchemist
github
similar
brycestx/perses_jacs_systems
github
similar
InformaticsMatters/docking-validation
github
similar
choderalab/fah-xchem
github
similar
alchemistry/soft-benchmarks
github
similar
choderalab/neutromeratio
github
similar
choderalab/protons
github
similar
openforcefield/smirnoff99Frosst
github
similar
essex-lab/grand
github
similar
mahendra-awale/medchem_moves
github
similar
bowman-lab/enspara
github
similar
JanainaCruz/DeepVS
github
similar
choderalab/qmlify
github
similar
MolSSI/QCPortal
github
similar
protocaller/ProtoCaller
github
similar
coarse-graining/cgnet
github
similar
MCompChem/fep-benchmark
github
similar
alchemistry/alchemical-best-practices
github
similar
openforcefield/protein-ligand-benchmark
github
similar
chopralab/lemon
github
similar
zlin7/CGNet
github
similar
FoldingAtHome/covid-moonshot
github
similar
open-reaction-database/ord-schema
github
similar
deGrootLab/pmx
github
similar
samirelanduk/atomium
github
similar
theochem/iodata
github
similar
proteneer/timemachine
github
similar
senya-ashukha/simple-equivariant-gnn
github
similar
choderalab/openmmtools
github
similar
lupoglaz/TorchProteinLibrary
github
similar
gnina/libmolgrid
github
similar
choderalab/perses
github
similar
MolSSI/QCFractal
github
similar
DrrDom/crem
github
similar
alchemistry/alchemlyb
github
similar
dsehnal/LiteMol
github
similar
choderalab/yank
github
similar
markovmodel/deeptime
github
similar
PatWalters/resources
github
similar
ccsb-scripps/AutoDock-GPU
github
similar