Reference interaction site model with structural descriptors correction as an efficient tool for hydration free energy predictions

Ratkova, Ekaterina L. and Sergiievskyi, Volodymyr P. and Chuev, Gennady N. and Fedorov, Maxim V. (2011) Reference interaction site model with structural descriptors correction as an efficient tool for hydration free energy predictions. Abstracts of papers - American Chemical Society, 241. -. ISSN 0065-7727

Abstract

This abstract discusses reference interaction site models with structural descriptors correction as an efficient tool for hydration free energy predictions.

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  Item type:	Article
  ID code:	35666
  Dates:	Date Event 27 March 2011 Published
  Subjects:	Science > Chemistry > Physical and theoretical chemistry
  Department:	Faculty of Science > Physics Technology and Innovation Centre > Bionanotechnology
  Depositing user:	Pure Administrator
  Date deposited:	09 Nov 2011 11:51
  Last modified:	11 Nov 2024 09:59
  URI:	https://strathprints.strath.ac.uk/id/eprint/35666