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Investigation of substituent effect of 1-(3, 3-diphenylpropyl)-piperidinyl phenylacetamides on CCR5 binding affinity using QSAR and virtual screening techniques.

Antreas AfantitisGeorgia MelagrakiHaralambos SarimveisPanayiotis A. KoutentisJohn MarkopoulosOlga Igglessi-Markopoulou
Published in: J. Comput. Aided Mol. Des. (2006)
Keyphrases
  • drug discovery
  • virtual screening
  • chemical structures
  • chemical compounds
  • pairwise
  • early stage
  • data mining
  • systems biology
  • databases
  • binding sites
  • data mining tools
  • similarity searching