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Journal of Chemical Theory and Computation 2017 / 09

Assessment of Methodology and Chemical Group Dependences in the Calculation of the pKa for Several Chemical Groups

Matsui, Toru, Shigeta, Yasuteru, Morihashi, Kenji
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Language:
english
Journal:
Journal of Chemical Theory and Computation
DOI:
10.1021/acs.jctc.7b00587
Date:
September, 2017
File:
PDF, 2.01 MB
english, 2017
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