Pinned Repositories
EquiScore
FEgrow
An Open-Source Molecular Builder and Free Energy Preparation Workflow
pymolsnips
Pymolsnips is a library of PyMOL scripting language code fragments for several popular text editors.
qmmm-workshop
Workshop teaching QMMM using Amber
TEFDTA
plip
Protein-Ligand Interaction Profiler - Analyze and visualize non-covalent protein-ligand interactions in PDB files according to 📝 Adasme et al. (2021), https://doi.org/10.1093/nar/gkab294
DeepGlycanSite
Mengo-ye's Repositories
Mengo-ye/pymolsnips
Pymolsnips is a library of PyMOL scripting language code fragments for several popular text editors.
Mengo-ye/qmmm-workshop
Workshop teaching QMMM using Amber
Mengo-ye/TEFDTA