CHBC Faculty Publications

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Author: Paizs, Béla

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TitlePublication NamePub. TypeYear
Geometry optimization and molecular dynamics in internal coordinates.Abstracts of Papers of the American Chemical SocietyAbstract2002
Newtonian molecular dynamics in general curvilinear internal coordinatesChemical Physics LettersJournal Article2002
Geometry optimization of large biomolecules in redundant internal coordinatesJournal of Chemical PhysicsJournal Article2000
An efficient direct method for geometry optimization of large molecules in internal coordinatesJournal of Chemical PhysicsJournal Article1998