QM/MM Simulations with the Gaussian Electrostatic Model: A Density-based Polarizable Potential
Gökcan, Hatice, Kratz, Eric, Darden, Thomas A., Piquemal, Jean-Philip, Cisneros, G. AndrésVolume:
9
Language:
english
Journal:
The Journal of Physical Chemistry Letters
DOI:
10.1021/acs.jpclett.8b01412
Date:
June, 2018
File:
PDF, 443 KB
english, 2018