Molecular modeling and simulation for proteins and polymer membranes
A computational framework was used to expand the applicable length and time scale of molecular dynamics simulations (MD) by developing a multiscale CG parameterization approach for biomolecules, and an investigation on the adsorption mechanism of an endocrine disrupting compound onto polymer membran...
Main Author: | Christian, Bope Domilongo |
---|---|
Other Authors: | Zhang Zuoqi |
Format: | Thesis |
Language: | English |
Published: |
2017
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Subjects: | |
Online Access: | http://hdl.handle.net/10356/72871 |
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