Adaptive Partitioning QM/MM for Molecular Dynamics Simulations: 6. Proton Transport through a Biological Channel. [electronic resource]
- Journal of chemical theory and computation Feb 2019
- 892-905 p. digital
Publication Type: Journal Article
1549-9626
10.1021/acs.jctc.8b01128 doi
Chloride Channels--chemistry Chlorides--metabolism Escherichia coli K12--chemistry Escherichia coli Proteins--chemistry Ion Transport Molecular Dynamics Simulation Protons