Integral equation theory of molecular solvation coupled with quantum mechanical/molecular mechanics method in nwchem package

Journal of Chemical Theory and Computation

Volumn 8, Issue 4, 2012, Pages 1246-1254

  Chuev, Gennady N ^a,b   Valiev, Marat ^c   Fedotova, Marina V ^d  

^a MAX PLANCK INSTITUTE FOR MATHEMATICS IN THE SCIENCES   (Germany)

^b INSTITUTE OF THEORETICAL AND EXPERIMENTAL BIOPHYSICS   (Russian Federation)

^c PACIFIC NORTHWEST NATIONAL LABORATORY   (United States)

^d INSTITUTE OF SOLUTION CHEMISTRY   (Russian Federation)

Author keywords

[No Author keywords available]

Indexed keywords

EID: 84859623262     PISSN: 15499618     EISSN: 15499626     Source Type: Journal    
DOI: 10.1021/ct2009297     Document Type: Article

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