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Proteins|October 10, 2009
Protein flexibility from discrete molecular dynamics simulations using quasi-physical potentialsAgustí Emperador, Tim Meyer, Modesto Orozco
Journal of Chemical Theory and Computation|December 2, 2015
United-Atom Discrete Molecular Dynamics of Proteins Using Physics-Based PotentialsAgustí Emperador, Tim Meyer, Modesto Orozco
Journal of Chemical Theory and Computation|February 4, 2017
Discrete Molecular Dynamics Approach to the Study of Disordered and Aggregating ProteinsAgustí Emperador, Modesto Orozco
Bioinformatics (Oxford, England)|June 7, 2013
Exploration of conformational transition pathways from coarse-grained simulationsPedro Sfriso, Adam Hospital, Agustí Emperador, et al.
Biophysical Journal|May 20, 2008
Exploring the suitability of coarse-grained techniques for the representation of protein dynamicsAgustí Emperador, Oliver Carrillo, Manuel Rueda, et al.
Journal of Chemical Theory and Computation|November 25, 2015
PACSAB: Coarse-Grained Force Field for the Study of Protein-Protein Interactions and Conformational Sampling in Multiprotein SystemsAgustí Emperador, Pedro Sfriso, Marcos Ariel Villarreal, et al.
Structure (London, England : 1993)|December 22, 2015
Residues Coevolution Guides the Systematic Identification of Alternative Functional Conformations in ProteinsPedro Sfriso, Miquel Duran-Frigola, Roberto Mosca, et al.
Advances in Protein Chemistry and Structural Biology|September 17, 2011
Coarse-grained representation of protein flexibility. Foundations, successes, and shortcomingsModesto Orozco, Laura Orellana, Adam Hospital, et al.
Structure (London, England : 1993)|January 15, 2009
An atomistic view to the gas phase proteomeTim Meyer, Xavier de la Cruz, Modesto Orozco
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