Elucidating the Conformational Dependence of Calculated p K a Values

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Bibliographic Details
Published in:Journal of chemical theory and computation 2006-07, Vol.2 (4), p.927-938
Main Authors: Livesay, Dennis R., Jacobs, Donald J., Kanjanapangka, Julie, Chea, Eric, Cortez, Hector, Garcia, Jorge, Kidd, Patrick, Marquez, Mario Pulido, Pande, Swati, Yang, David
Format: Article
Language:English
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ISSN:1549-9618
1549-9626
DOI:10.1021/ct600066z