Machine Learning of Parameters for Accurate Semiempirical...

Journal of Chemical Theory and Computation 2015 / 05 Vol. 11; Iss. 5

Machine Learning of Parameters for Accurate Semiempirical Quantum Chemical Calculations

Dral, Pavlo O., von Lilienfeld, O. Anatole, Thiel, Walter
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Volume:
11
Language:
english
Journal:
Journal of Chemical Theory and Computation
DOI:
10.1021/acs.jctc.5b00141
Date:
May, 2015
File:
PDF, 377 KB
english, 2015
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