Reverse Dependencies of qcengine
The following projects have a declared dependency on qcengine:
- bigchem — A distributed system for scaling and parallelizing quantum chemistry calculations
- peslearn — Automated Construction of Machine Learning Models of Molecular Potential Energy Surfaces.
- pysisyphus — Python suite for exploring potential energy surfaces.
- qcarchivetesting — A distributed compute and database platform for quantum chemistry.
- qcmanybody — QCManyBody
- qcop — A package for operating Quantum Chemistry programs using qcio standardized data structures. Compatible with TeraChem, psi4, QChem, NWChem, ORCA, Molpro, geomeTRIC and many more.
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