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

Ekaterina L. Ratkova, Volodymyr P. Sergiievskyi, Gennady N. Chuev, Maxim V. Fedorov

Research output: Contribution to journalSpecial issue

Abstract

This abstract discusses reference interaction site models with structural descriptors correction as an efficient tool for hydration free energy predictions.
Original languageEnglish
Pages (from-to)-
Number of pages1
JournalAbstracts of papers - American Chemical Society
Volume241
Publication statusPublished - 27 Mar 2011

Keywords

  • interaction site model
  • energy predictions

Fingerprint Dive into the research topics of 'Reference interaction site model with structural descriptors correction as an efficient tool for hydration free energy predictions'. Together they form a unique fingerprint.

  • Cite this