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Electrostatic interactions in molecular mechanics (MM2) calculations via PEOE partial charges I. Haloalkanes
Lars-Gunnar Hammarström, Tommy Liljefors, Johann GasteigerVolume:
9
Year:
1988
Language:
english
Pages:
17
DOI:
10.1002/jcc.540090418
File:
PDF, 1.53 MB
english, 1988