Electrostatics /PDB2PQR
Biomolecular titration state and charge assignment
★ 177 · Updated 5d ago · Licence unknown
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Electrostatics /PDB2PQR
Biomolecular titration state and charge assignment
★ 177 · Updated 5d ago · Licence unknown
Electrostatics /APBS
Biomolecular electrostatics and solvation calculations
★ 141 · Updated 3d ago · Licence unknown
Graylab /DL4Proteins-notebooks
Colab Notebooks covering deep learning tools for biomolecular structure prediction and design
★ 732 · Updated 6mo ago · MIT
openmm /PDBFixer
PDBFixer fixes problems in PDB files
★ 671 · Updated 7mo ago · Licence unknown
westlake-repl /SaprotHub
Making Protein Language Modeling Accessible to All Biologists
★ 170 · Updated 7d ago · MIT
locbp-uzh /biopipelines
Protein and ligand engineering workflows
★ 107 · Updated 6w ago · MIT