A wrapper for Quantum Chemistry engines that adheres to the MolSSI (molssi.org) QCSchema.
copied from cf-post-staging / qcengineconda install conda-forge::qcengineconda install conda-forge/label/cf201901::qcengineconda install conda-forge/label/cf202003::qcengineconda install conda-forge/label/gcc7::qcengineconda install conda-forge/label/qcengine_dev::qcengine