Agustí Emperador

FlexServ: an integrated tool for the analysis of protein flexibility

Modesto Orozco, Jordi Camps, Oliver Carrillo, 2009, Bioinform..

Optimizing a coarse-grained model for the recognition of protein-protein binding

Agustí Emperador, Modesto Orozco, 2015 .

Coarse-grained representation of protein flexibility. Foundations, successes, and shortcomings.

Modesto Orozco, Athi N. Naganathan, Oliver Carrillo, 2011, Advances in protein chemistry and structural biology.

Discrete Molecular Dynamics Approach to the Study of Disordered and Aggregating Proteins.

Modesto Orozco, Agustí Emperador, M. Orozco, 2017, Journal of chemical theory and computation.

Exploration of conformational transition pathways from coarse-grained simulations

Modesto Orozco, Agustí Emperador, Adam Hospital, 2013, Bioinform..

PACSAB: Coarse-Grained Force Field for the Study of Protein-Protein Interactions and Conformational Sampling in Multiprotein Systems.

Modesto Orozco, Agustí Emperador, Josep Lluis Gelpí, 2015, Journal of chemical theory and computation.

Protein flexibility from discrete molecular dynamics simulations using quasi‐physical potentials

Modesto Orozco, Agustí Emperador, Tim Meyer, 2010, Proteins.

United-Atom Discrete Molecular Dynamics of Proteins Using Physics-Based Potentials.

Modesto Orozco, Agustí Emperador, Tim Meyer, 2008, Journal of chemical theory and computation.

Exploring the suitability of coarse-grained techniques for the representation of protein dynamics.

Modesto Orozco, Agustí Emperador, Manuel Rueda, 2008, Biophysical journal.

Residues Coevolution Guides the Systematic Identification of Alternative Functional Conformations in Proteins.

Modesto Orozco, Patrick Aloy, Roberto Mosca, 2016, Structure.