Integrating conformational and protonation equilibria in biomolecular modeling
<p> Due to high sensitivity of biomolecular systems to the electrostatic environments, coupled treatment of conformational and protonation equilibria is required for an accurate characterization of true ensemble of a given system. The research presented in this dissertation examines the effect...
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| Language: | EN |
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University of California, San Diego
2015
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| Online Access: | http://pqdtopen.proquest.com/#viewpdf?dispub=3709257 |