A Smoothed Backbone-Dependent Rotamer Library for Proteins Derived from Adaptive Kernel Density Estimates and Regressions
Maxim V. Shapovalov, Roland L. Dunbrack
Topics & Concepts
Conformational isomerismDihedral angleKernel (algebra)Degrees of freedom (physics and chemistry)Probability density functionFunction (biology)MathematicsChemistryStatisticsCombinatoricsPhysicsMoleculeThermodynamicsBiologyEvolutionary biologyOrganic chemistryHydrogen bondProtein Structure and DynamicsEnzyme Structure and FunctionRNA and protein synthesis mechanisms