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  • An unofficial binary of RDKit for Python3.6 and Windows

    Updated Nov 1, 2017
  • A program to perform Huckel molecular orbital caluclations on molecules.

    C++ 2 BSD 3-Clause "New" or "Revised" License Updated Sep 29, 2017
  • A cross-platform implementation of "backtrace<execinfo.h>".

    C++ 2 1 BSD 3-Clause "New" or "Revised" License Updated Aug 23, 2017
  • A test project

    C++ Updated Aug 23, 2017
  • psi4

    Forked from psi4/psi4

    Open-Source Quantum Chemistry – an electronic structure package in C++ driven by Python

    C++ 195 GNU Lesser General Public License v3.0 Updated Aug 23, 2017
  • The final project for the MolSSI 2017 summer school.

    Python 44 BSD 3-Clause "New" or "Revised" License Updated Aug 2, 2017
  • A "Linux-time"-like program for Windows platform.

    C++ 1 BSD 3-Clause "New" or "Revised" License Updated Aug 1, 2017
  • A python toolkit for unit conventions for quantum chemists.

    Python BSD 3-Clause "New" or "Revised" License Updated Jul 31, 2017