Toward Determining ATPase Mechanism in ABC Transporters: Development of the Reaction Path–Force Matching QMMM Method by Y. Zhou & P. Ojeda-May & M. Nagaraju & J. Pu

Toward Determining ATPase Mechanism in ABC Transporters: Development of the Reaction Path–Force Matching QMMM Method by Y. Zhou & P. Ojeda-May & M. Nagaraju & J. Pu

Author:Y. Zhou & P. Ojeda-May & M. Nagaraju & J. Pu
Format: pdf
Tags: ABC transporter, ATP hydrolysis, Enzyme mechanism, Force matching, Free energy simulation, Multiscale simulation, Proton transfer, QM/MM, Reaction path, Specific reaction parameter
Publisher: Elsevier Inc.
Published: 2016-07-29T09:38:41+00:00


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