Global optimization using metadynamics and a polarizable force field: application to protein loops
Genetic sequences are being collected at an ever increasing rate due to rapid cost reductions; however, experimental approaches to determine the structure and function of the protein(s) each gene codes are not keeping pace. Therefore, computational methods to augment experimental structures with com...
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Format: | Others |
Language: | English |
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University of Iowa
2016
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Online Access: | https://ir.uiowa.edu/etd/3043 https://ir.uiowa.edu/cgi/viewcontent.cgi?article=6387&context=etd |