A review on description dynamics and conformational changes of proteins using combination of principal component analysis and molecular dynamics simulation
Sajad Moradi, Amin Nowroozi, Mohammad Aryaei Nezhad, Parvin Jalali, Rasool Khosravi, Mohsen Shahlaei
Topics & Concepts
Molecular dynamicsDynamics (music)Principal component analysisComponent (thermodynamics)Biological systemComputer scienceStatistical physicsChemistryComputational chemistryArtificial intelligencePhysicsBiologyThermodynamicsAcousticsProtein Structure and DynamicsComputational Drug Discovery MethodsAnalytical Chemistry and Chromatography