All Git Users → qcscine

2 open source projects by qcscine

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1. molassembler

Chemoinformatics toolkit with support for inorganic molecules

✭ 18

C++CMake python TeX r c chemistry chemoinformatics molecule-builder

Release-only repository for SCINE QCMaquis, the DMRG software from the Reiher group.

✭ 18

C++c python CMake TeX fortran chemistry computational-chemistry quantum-chemistry quantum-chemistry-methods

1-2 of 2 user projects