Similar repositories to volkamerlab/maxsmi:
volkamerlab/maxsmi
github
similar
SMVDGroup/SCORCH
github
similar
jnwei/neural_reaction_fingerprint
github
similar
Laboratoire-de-Chemoinformatique/hyfactor
github
similar
yvquanli/GLAM
github
similar
radifar/PyPLIF-HIPPOS
github
similar
wenhao-gao/mol_opt
github
similar
ml-jku/mgenerators-failure-modes
github
similar
nanxstats/logd74
github
similar
hasic-haris/one_step_retrosynth_ai
github
similar
LBLQMM/MACAW
github
similar
openkinome/kinodata
github
similar
MolecularAI/Icolos
github
similar
karanicolaslab/combichem
github
similar
MolecularAI/DockStreamCommunity
github
similar
MolecularAI/reinvent-hitl
github
similar
Jonas-Verhellen/MolecularGraphPareto
github
similar
Team-SKI/snippets
github
similar
lifanchen-simm/transfomerCPI2.0
github
similar
hutchisonlab/molecular-entropies
github
similar
KeenThera/fragment_generation
github
similar
swansonk14/chemprop-factor
github
similar
DeepRank/PoNDeR
github
similar
bayer-science-for-a-better-life/neuraldecipher
github
similar
DIFACQUIM/ECIF
github
similar
volkamerlab/KinFragLib
github
similar
gnina/SolTranNet
github
similar
maxime-langevin/scaffold-constrained-generation
github
similar
czodrowskilab/VSFlow
github
similar
coleygroup/Graph2SMILES
github
similar
PatWalters/silly_walks
github
similar
batmanlab/drugEmbedding
github
similar
ETHmodlab/molecular_design_with_beam_search
github
similar
wengong-jin/abdockgen
github
similar
duaibeom/MolFinder
github
similar
whitead/molcloud
github
similar
akensert/molgraph
github
similar
jrwnter/gruenifai
github
similar
volkamerlab/kissim
github
similar
MolecularAI/Deep-Drug-Coder
github
similar