CG2AA: Backmapping protein coarse-grained structures

Coarse grain (CG) models allow long-scale simulations with a much lower computational cost than that of all-atom simulations. However, the absence of atomistic detail impedes the analysis of specific atomic interactions that are determinant in most interesting biomolecular processes. In order to stu...

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Detalles Bibliográficos
Autores principales:	Lombardi, L.E., Martí, M.A., Capece, L.
Formato:	JOUR
Materias:	protein algorithm chemistry molecular dynamics software Algorithms Molecular Dynamics Simulation Proteins Software
Acceso en línea:	http://hdl.handle.net/20.500.12110/paper_13674803_v32_n8_p1235_Lombardi
Aporte de:	Biblioteca Digital - Facultad de Ciencias Exactas y Naturales (UBA) de Universidad de Buenos Aires

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