Molecular Dynamics SimulationComputer SimulationModels, MolecularThermodynamicsModels, ChemicalProtein ConformationMolecular ConformationProtein Structure, SecondaryHydrogen BondingWaterLipid BilayersProtein BindingBinding SitesProtein Structure, TertiaryModels, BiologicalCrystallography, X-RayMolecular Sequence DataAmino Acid SequenceSolventsAmino Acid SubstitutionHydrophobic and Hydrophilic InteractionsStatic ElectricityMagnetic Resonance SpectroscopyModels, AnatomicStructure-Activity RelationshipProtein FoldingAlgorithmsBiomechanical PhenomenaModels, TheoreticalMonte Carlo MethodSoftwarePatient SimulationKineticsComputational BiologyModels, StatisticalPeptidesMolecular Docking SimulationMutationStochastic ProcessesModels, GeneticBiophysicsMotionManikinsBiophysical PhenomenaModels, CardiovascularDiffusionReproducibility of ResultsTime FactorsFinite Element AnalysisPhantoms, ImagingModels, NeurologicalData Interpretation, StatisticalQuantum TheoryLikelihood FunctionsTemperatureHydrodynamicsProteinsComputer-Aided DesignMarkov ChainsBayes TheoremSolutionsComputersEntropyEquipment DesignImaging, Three-DimensionalNumerical Analysis, Computer-AssistedMathematicsIonsSample SizeDimyristoylphosphatidylcholineStress, MechanicalNucleic Acid ConformationEquipment Failure AnalysisLigands