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ELECTROSTATICS IN COMPUTER-AIDED DRUG DESIGN

Hydrogen bonds and charge-charge interactions, determined by molecular electrostatics, play essential role in biopolymer-ligand associations. Accordingly, electrostatics is crucial in the qualitative and quantitative characterisation of the binding of drugs to their target molecules. In the followi...

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Autori principali: GABOR NARAY-SZABO, PETER MATYUS
Natura: Artigo
Lingua:Inglês
Pubblicazione: Gdańsk University of Technology 1998-10-01
Serie:TASK Quarterly
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Accesso online:https://journal.mostwiedzy.pl/TASKQuarterly/article/view/2381
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