Pinned Repositories
deep_frag
equidock_public
EquiDock: geometric deep learning for fast rigid 3D protein-protein docking
masif
MaSIF- Molecular surface interaction fingerprints. Geometric deep learning to decipher patterns in molecular surfaces.
workshop_git
workshop_jenkins
example
peleffy
The peleffy (PELE Force Field Yielder) is a Python package that builds PELE-compatible force field templates.
peleffy-benchmarks
A compilation of benchmarks to validate the parameterization of peleffy (PELE Force Field Yielder).
laumalo's Repositories
laumalo/deep_frag
laumalo/equidock_public
EquiDock: geometric deep learning for fast rigid 3D protein-protein docking
laumalo/masif
MaSIF- Molecular surface interaction fingerprints. Geometric deep learning to decipher patterns in molecular surfaces.
laumalo/workshop_git
laumalo/workshop_jenkins
example