Showing results (11-20 of 246) with videos related to
Sort By:
Pageof 25
Chemmedchem|July 13, 2026
The Role of Water in Protein-Ligand Binding: Decisive Factor, Annoying Feature, or Indispensable Control Element: In Any Case, a Major ChallengeGerhard KlebeProteins|November 19, 2011
Cofactor-binding sites in proteins of deviating sequence: comparative analysis and clustering in torsion angle, cavity, and fold spaceBjörn Stegemann, Gerhard KlebeJournal of Medicinal Chemistry|September 6, 2002
DrugScore meets CoMFA: adaptation of fields for molecular comparison (AFMoC) or how to tailor knowledge-based pair-potentials to a particular proteinHolger Gohlke, Gerhard KlebeAngewandte Chemie (International Ed. in English)|August 31, 2002
Approaches to the description and prediction of the binding affinity of small-molecule ligands to macromolecular receptorsHolger Gohlke, Gerhard KlebeJournal of Medicinal Chemistry|October 16, 2004
Successful virtual screening for a submicromolar antagonist of the neurokinin-1 receptor based on a ligand-supported homology modelAndreas Evers, Gerhard KlebeJournal of Chemical Information and Modeling|July 10, 2013
Cavities tell more than sequences: exploring functional relationships of proteases via binding pocketsSerghei Glinca, Gerhard KlebeBiochimica Et Biophysica Acta. General Subjects|November 16, 2020
Simultaneous determination of thermodynamic and kinetic data by isothermal titration calorimetrySteffen Glöckner, Gerhard KlebeProteins|August 16, 2008
Turns revisited: a uniform and comprehensive classification of normal, open, and reverse turn families minimizing unassigned random chain portionsOliver Koch, Gerhard KlebeJournal of Medicinal Chemistry|April 5, 2002
Development of new hydrogen-bond descriptors and their application to comparative molecular field analysesMarkus Böhm, Gerhard KlebeJournal of Chemical Information and Modeling|January 24, 2008
Use of 3D QSAR models for database screening: a feasibility studyAlexander Hillebrecht, Gerhard KlebePageof 25