Electrostatics / pdb2pqr

PDB2PQR - determining titration states, adding missing atoms, and assigning charges/radii to biomolecules.
http://www.poissonboltzmann.org/
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Release PDB2PQR 3.6.1 #349

Closed sobolevnrm closed 1 year ago

sobolevnrm commented 1 year ago
sobolevnrm commented 1 year ago

See https://pypi.org/project/pdb2pqr/3.6.1/