Gennady M Verkhivker

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Gennady M



Publications in SciGraph latest 50 shown

  • 2018-12 Dissecting Structure-Encoded Determinants of Allosteric Cross-Talk between Post-Translational Modification Sites in the Hsp90 Chaperones in SCIENTIFIC REPORTS
  • 2018 Computational Modeling of the Hsp90 Interactions with Cochaperones and Small-Molecule Inhibitors in CHAPERONES
  • 2009 Coarse-Grained Modeling of the HIV–1 Protease Binding Mechanisms: II. Folding Inhibition in COMPUTATIONAL INTELLIGENCE METHODS FOR BIOINFORMATICS AND BIOSTATISTICS
  • 2009 Coarse-Grained Modeling of the HIV–1 Protease Binding Mechanisms: I. Targeting Structural Flexibility of the Protease Flaps and Implications for Drug Design in COMPUTATIONAL INTELLIGENCE METHODS FOR BIOINFORMATICS AND BIOSTATISTICS
  • 2007 Computational Proteomics of Biomolecular Interactions in Sequence and Structure Space of the Tyrosine Kinome: Evolutionary Constraints and Protein Conformational Selection Determine Binding Signatures of Cancer Drugs in APPLICATIONS OF FUZZY SETS THEORY
  • 2005 A Microscopic Study of Disorder-Order Transitions in Molecular Recognition of Unstructured Proteins: Hierarchy of Structural Loss and the Transition State Determination from Monte Carlo Simulations of P27KIP1 Protein Coupled Unfolding and Unbinding in SUPRAMOLECULAR STRUCTURE AND FUNCTION 8
  • 2005 Computational Detection of the Binding Site Hot Spot and Predicting Energetics of Ligand Binding at the Remodeled Human Growth Hormone-Receptor Interface Using a Hierarchy of Molecular Docking and Binding Free Energy Approaches in SUPRAMOLECULAR STRUCTURE AND FUNCTION 8
  • 2001-09 Conformational Composition of 5-Alkyl-1,3-Oxathianes in RUSSIAN JOURNAL OF GENERAL CHEMISTRY
  • 2000-11 Deciphering common failures in molecular docking of ligand-protein complexes in JOURNAL OF COMPUTER-AIDED MOLECULAR DESIGN
  • 1999-02 Examining ligand-protein interactions with binding-energy landscapes in THEORETICAL CHEMISTRY ACCOUNTS
  • 1997 New trends in computational structure prediction of ligand-protein complexes for receptor-based drug design in COMPUTER SIMULATION OF BIOMOLECULAR SYSTEMS
  • 1994 Moil: A Molecular Dynamics Program with Emphasis on Conformational Searches and Reaction Path Calculations in STATISTICAL MECHANICS, PROTEIN STRUCTURE, AND PROTEIN SUBSTRATE INTERACTIONS
  • 1985-07 A possible approach to determination of the preferred conformations in substituted saturated seven-membered rings in JOURNAL OF STRUCTURAL CHEMISTRY
  • 1981-01 The predominant conformation of 1,3-dioxepane in THEORETICAL AND EXPERIMENTAL CHEMISTRY
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