p K a Calculations in Solution and Proteins with QM/MM Free Energy Perturbation Simulations: A Quantitative Test of QM/MM Protocols
Year: 2005
Type: article
DOI: 10.1021/jp0517192
Authors: Demian Riccardi, Patricia Schaefer, Qiang Cui
Institution: University of Wisconsin–Madison
Language: English
Subfield: Atomic and Molecular Physics, and Optics
Field: Physics and Astronomy
Domain: Physical Sciences
Open Access status: closed
OpenAlex ID: W2159689520