tpregan

tpregan's Stars

• MolSSI/QCPortal

  A client interface to the QCArchive Project (read-only image of QCFractal)

  Language:Python3513

• MolSSI/QCElemental

  Periodic table, physical constants, and molecule parsing for quantum chemistry.

  Language:Python14370

• MolSSI/QCSchema

  A Schema for Quantum Chemistry

  Language:Python9636

• MolSSI/QCFractal

  A distributed compute and database platform for quantum chemistry.

  Language:Python14848