Discrete Molecular Dynamics Distinguishes Nativelike Binding Poses from Decoys in Difficult Targets

Lignende værker

• APPLICATIONS OF DISCRETE MOLECULAR DYNAMICS IN BIOLOGY AND MEDICINE
  af: Proctor, Elizabeth A., et al.
  Udgivet: (2015)
• Cheminformatics Meets Molecular Mechanics: A Combined Application of Knowledge-based Pose Scoring and Physical Force Field-based Hit Scoring Functions Improves the Accuracy of Structure-Based Virtual Screening
  af: Hsieh, Jui-Hua, et al.
  Udgivet: (2011)
• Probing protein aggregation using simplified models and discrete molecular dynamics
  af: Sharma, Shantanu, et al.
  Udgivet: (2008)
• Combined application of cheminformatics- and physical force field-based scoring functions improves binding affinity prediction for CSAR datasets
  af: Hsieh, Jui-Hua, et al.
  Udgivet: (2011)
• Fast screening of protein surfaces using geometric invariant fingerprints
  af: Yin, Shuangye, et al.
  Udgivet: (2009)