Similar repositories to capoe/libpqr:
capoe/libpqr
github
similar
Sulstice/global-chem
github
similar
igashov/DiffLinker
github
similar
google-research/tuning_playbook
github
similar
yutxie/MARS
github
similar
KeenThera/fragment_generation
github
similar
zchwang/DeepRMSD-Vina_Optimization
github
similar
matteoferla/Python_SmallWorld_API
github
similar
hainm/molstarview
github
similar
pfnet-research/RJT-RL
github
similar
njchoma/DGAPN
github
similar
zhenglz/OnionNet-SFCT
github
similar
ChloeKong/RG-MPNN
github
similar
keiradams/SQUID
github
similar
pdynamo/pDynamo3
github
similar
kimandsharp/dockeye_multi
github
similar
mohammadpz/pytorch_forward_forward
github
similar
luost26/diffab
github
similar
futianfan/reinforced-genetic-algorithm
github
similar
zaixizhang/FLAG
github
similar
PNNL-CompBio/3D_Scaffold
github
similar
iktos/generation-under-synthetic-constraint
github
similar
mwojcikowski/FastJTNNpy3
github
similar
SMVDGroup/SCORCH
github
similar
jnwei/neural_reaction_fingerprint
github
similar
nanxstats/targetnet
github
similar
sc8668/RTMScore
github
similar
ZiqiaoZhang/FraGAT
github
similar
ZimmermanGroup/conformer-rl
github
similar
li-jin-xing/RDPSOVina
github
similar
Fischer19/Junction_Tree_VAE_Bayesian_Optimization
github
similar
MolecularAI/molwall
github
similar
coleygroup/dsp
github
similar
oxpig/fragment-ranking
github
similar
a-r-j/DrugTranslatoR
github
similar
zhenglz/onionnet-v2
github
similar
olsson-group/RL-GraphINVENT
github
similar
MolecularAI/reinvent-hitl
github
similar
capoe/benchml
github
similar
zjujdj/InteractionGraphNet
github
similar