search

openmm / pdbfixer

PDBFixer fixes problems in PDB files
Other
453 stars 114 forks source link

Added boxShape option to addSolvent() #245

Closed peastman closed 2 years ago

peastman commented 2 years ago

This adds support for an option that was added in https://github.com/openmm/openmm/pull/3480.