Article ID Journal Published Year Pages File Type
5382612 Chemical Physics Letters 2013 8 Pages PDF
Abstract
► Proposed a continuum membrane representation in the Amber molecular mechanics model. ► Implemented the model with differential geometry concepts for efficiency. ► Adapted high-accuracy numerical solvers to more robust solvation modeling. ► Laid foundation for extension to more realistic modeling of membrane environment.
Related Topics
Physical Sciences and Engineering Chemistry Physical and Theoretical Chemistry
Authors
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