Similar repositories to whitead/dmol-book:
whitead/dmol-book
github
similar
ur-whitelab/exmol
github
similar
danistefanovic/build-your-own-x
github
similar
mir-group/nequip
github
similar
aspuru-guzik-group/selfies
github
similar
torchmd/torchmd
github
similar
datamol-org/datamol
github
similar
cbouy/mols2grid
github
similar
aiqm/torchani
github
similar
atomistic-machine-learning/schnetpack
github
similar
PatWalters/practical_cheminformatics_tutorials
github
similar
MolSSI/cookiecutter-cms
github
similar
materialsvirtuallab/megnet
github
similar
volkamerlab/teachopencadd
github
similar
kjelljorner/morfeus
github
similar
grimme-lab/xtb
github
similar
wjm41/molplotly
github
similar
Mariewelt/OpenChem
github
similar
materialsvirtuallab/maml
github
similar
hsiaoyi0504/awesome-cheminformatics
github
similar
lmmentel/awesome-python-chemistry
github
similar
SINGROUP/dscribe
github
similar
tuvtran/project-based-learning
github
similar
MolecularAI/GraphINVENT
github
similar
HannesStark/EquiBind
github
similar
chemprop/chemprop
github
similar
a-r-j/graphein
github
similar
tilde-lab/awesome-materials-informatics
github
similar
awslabs/dgl-lifesci
github
similar
drorlab/atom3d
github
similar
hesther/espsim
github
similar
mir-group/flare
github
similar
openforcefield/openff-toolkit
github
similar
e3nn/e3nn
github
similar
Open-Catalyst-Project/ocp
github
similar
pablo-arantes/making-it-rain
github
similar
lukasturcani/stk
github
similar
chemosim-lab/ProLIF
github
similar
aamini/chemprop
github
similar
sha256feng/mldl-md-dynamics
github
similar