"The adaptive buffered force QM/MM method in the CP2K and AMBER software ..."

Letif Mones et al. (2015)

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DOI: 10.1002/JCC.23839

access: open

type: Journal Article

metadata version: 2020-09-05

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Letif Mones, Andrew Jones, Andreas W. Götz, Teodoro Laino, Ross C. Walker, Ben Leimkuhler, Gábor Csányi, Noam Bernstein:
The adaptive buffered force QM/MM method in the CP2K and AMBER software packages. J. Comput. Chem. 36(9): 633-648 (2015)

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