November 28, 2014

The CHARMM-TURBOMOLE Interface for Efficient and Accurate QM/MM Molecular Dynamics, Free Energies, and Excited State Properties.→

November 28, 2014/ Christopher Rowley

The CHARMM-TURBOMOLE Interface for Efficient and Accurate QM/MM Molecular Dynamics, Free Energies, and Excited State Properties.

Riahi, S., Rowley C.N. J. Comput. Chem. 2014, 35, 2076–2086. doi: 10.1002/jcc.23716 [PDF preprint]

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Carleton University
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