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Structure (London, England : 1993)|September 3, 2013
Efficient and robust analysis of biomacromolecular flexibility using ensembles of network topologies based on fuzzy noncovalent constraintsChristopher Pfleger, Holger GohlkeJournal of Chemical Information and Modeling|August 21, 2007
DrugScoreRNA--knowledge-based scoring function to predict RNA-ligand interactionsPatrick Pfeffer, Holger GohlkeScientific Reports|August 16, 2017
On the potential alternate binding change mechanism in a dimeric structure of Pyruvate Phosphate DikinaseDaniel Ciupka, Holger GohlkeBiochimica Et Biophysica Acta|December 3, 2014
Extension of the free energy workflow FEW towards implicit solvent/implicit membrane MM-PBSA calculationsNadine Homeyer, Holger GohlkeMolecular Informatics|August 2, 2016
Free Energy Calculations by the Molecular Mechanics Poisson-Boltzmann Surface Area MethodNadine Homeyer, Holger GohlkeJournal of Chemical Information and Modeling|December 15, 2022
Cumulative Millisecond-Long Sampling for a Comprehensive Energetic Evaluation of Aqueous Ionic Liquid Effects on Amino Acid InteractionsTill El Harrar, Holger GohlkeCurrent Medicinal Chemistry|October 5, 2006
Targeting protein-protein interactions with small molecules: challenges and perspectives for computational binding epitope detection and ligand findingDomingo González-Ruiz, Holger GohlkePlos One|June 23, 2017
Ligand-mediated and tertiary interactions cooperatively stabilize the P1 region in the guanine-sensing riboswitchChristian A Hanke, Holger GohlkeJournal of Chemical Information and Modeling|October 3, 2009
Steering protein-ligand docking with quantitative NMR chemical shift perturbationsDomingo González-Ruiz, Holger GohlkeBiophysical Journal|July 4, 2006
A natural coarse graining for simulating large biomolecular motionHolger Gohlke, M F ThorpePageof 30