A kinetic ensemble of the Alzheimer’s Aβ peptide
Thomas Löhr, Kai Kohlhoff, Gabriella T. Heller, Carlo Camilloni, Michele Vendruscolo
Topics & Concepts
Kinetic energyMicrosecondStatistical physicsProbabilistic logicMarkov chainConformational ensemblesKineticsChemistryMolecular dynamicsComputer scienceThermodynamicsPhysicsComputational chemistryArtificial intelligenceMachine learningQuantum mechanicsProtein Structure and DynamicsComputational Drug Discovery Methodsthermodynamics and calorimetric analyses