Similar repositories to GiovanniBussi/plumed_input_builder_example:
GiovanniBussi/plumed_input_builder_example
github
similar
ljmartin/dockop
github
similar
cimm-kzn/3D-MIL-QSAR
github
similar
coleygroup/molpal
github
similar
mattragoza/liGAN
github
similar
choderalab/openmmtools
github
similar
plumed/plumed2
github
similar
mir-group/flare
github
similar
jonathanking/sidechainnet
github
similar
ccsb-scripps/AutoDock-GPU
github
similar
mir-group/nequip
github
similar
mdtraj/mdtraj
github
similar
prody/ProDy
github
similar
oddt/oddt
github
similar
SINGROUP/dscribe
github
similar
PatWalters/practical_cheminformatics_tutorials
github
similar
gnina/gnina
github
similar
aiqm/torchani
github
similar
HannesStark/EquiBind
github
similar
charnley/rmsd
github
similar
atomistic-machine-learning/schnetpack
github
similar
kexinhuang12345/DeepPurpose
github
similar
schrodinger/pymol-open-source
github
similar
a-r-j/graphein
github
similar
deepmodeling/deepmd-kit
github
similar
openmm/openmm
github
similar
aqlaboratory/openfold
github
similar
deepchem/deepchem
github
similar
deepmind/alphafold
github
similar
fchollet/deep-learning-with-python-notebooks
github
similar
google/python-fire
github
similar
nativefier/nativefier
github
similar
vinta/awesome-python
github
similar