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1. bmapqml bmapqml Public

   Machine learning for target property optimization.

   Python

2. oml-qml oml-qml Public

   A fork of QML project contaning routines for machine learning from cheap ab initio calculations.

   Python

3. qml qml Public

   Forked from qmlcode/qml

   QML: Quantum Machine Learning

   Python 1

4. qmllib qmllib Public

   Forked from qmlcode/qmllib

   QML core fortran functions

   Fortran

5. chemspacelab/mosaics chemspacelab/mosaics Public

   Evolutionary Monte Carlo algorithm for optimization in chemical space.

   Python 12 1

6. qml2code/qml2 qml2code/qml2 Public

   Procedures for machine learning in chemistry.

   Python