Similar repositories to rhara/chime:
rhara/chime
github
similar
0ut0fcontrol/isoRMSD
github
similar
CheML/CheML
github
similar
molmod/zeobuilder
github
similar
fmonta/mtnngc_admet
github
similar
sirmarcel/cmlkit
github
similar
lishuya17/MONN
github
similar
BingqingCheng/ML-in-chemistry-101
github
similar
kexinhuang12345/SkipGNN
github
similar
blackmints/3DGCN
github
similar
mcocdawc/chemcoord
github
similar
crcollins/molml
github
similar
jensengroup/molcalc
github
similar
LLNL/FAST
github
similar
SSAGESproject/SSAGES
github
similar
edvardlindelof/graph-neural-networks-for-drug-discovery
github
similar
muammar/ml4chem
github
similar
materialsvirtuallab/mlearn
github
similar
clinfo/kGCN
github
similar
leeping/forcebalance
github
similar
wjm41/molplotly
github
similar
gjoni/trDesign
github
similar
masashitsubaki/molecularGNN_smiles
github
similar
openmm/pdbfixer
github
similar
lukasturcani/stk
github
similar
mufeili/DL4MolecularGraph
github
similar
nicola-decao/MolGAN
github
similar
dftbplus/dftbplus
github
similar
aiqm/torchani
github
similar
pyiron/pyiron
github
similar
MolSSI/cookiecutter-cms
github
similar
oddt/oddt
github
similar
grimme-lab/xtb
github
similar
mims-harvard/decagon
github
similar
materialsvirtuallab/megnet
github
similar
a-r-j/graphein
github
similar
gnn4dr/DRKG
github
similar
QEF/q-e
github
similar
Mariewelt/OpenChem
github
similar
chainer/chainer-chemistry
github
similar