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A novel approach for studying receptor-ligand interactions on living cells surface by using NUS/T1ρ-NMR methodologies combined with computational techniques: The RGDechi15D-α<sub>v</sub>β<sub>5</sub> integrin complex

artículo científico publicado en 2021

Allosteric Modulators of HSP90 and HSP70: Dynamics Meets Function through Structure-Based Drug Design

article

CALCOM: a software for calculating the center of mass of proteins.

artículo científico publicado en 2008

Chemical Perturbation of Oncogenic Protein Folding: from the Prediction of Locally Unstable Structures to the Design of Disruptors of Hsp90-Client Interactions

artículo científico publicado en 2020

Covalent Inhibitors of Plasmodium falciparum Glyceraldehyde 3-Phosphate Dehydrogenase with Antimalarial Activity in Vitro

artículo científico publicado en 2019

Exploring the antimalarial potential of the methoxy-thiazinoquinone scaffold: Identification of a new lead candidate

scientific article published on 03 January 2019

Functional hypothesis on miraculin' sweetness by a molecular dynamics approach.

artículo científico publicado en 2010

High Affinity vs. Native Fibronectin in the Modulation of αvβ3 Integrin Conformational Dynamics: Insights from Computational Analyses and Implications for Molecular Design

artículo científico publicado en 2017

Insights into structure, stability, and toxicity of monomeric and aggregated polyglutamine models from molecular dynamics simulations.

artículo científico publicado en 2008

Mechanistic Model for the Hsp90-Driven Opening of Human Argonaute

artículo científico publicado en 2020

Molecular basis of substrate-induced permeation by an amino acid antiporter

artículo científico publicado en 2011

Molecular modelling of miraculin: Structural analyses and functional hypotheses.

artículo científico publicado en 2007

Propensities for loop structures of RNA & DNA backbones.

artículo científico publicado en 2013

Ribose 2'-Hydroxyl Groups Stabilize RNA Hairpin Structures Containing GCUAA Pentaloop.

artículo científico publicado en 2013

Role of the conformational versatility of the neurotrophin N-terminal regions in their recognition by Trk receptors.

artículo científico publicado en 2010

Structural Characterization of the FlmC Protein Involved in Biofilm Formation

artículo científico publicado en 2018

Structural Stability and Flexibility Direct the Selection of Activating Mutations in Epidermal Growth Factor Receptor Kinase

artículo científico publicado en 2015

The Dynamics of Drug Discovery.

artículo científico

The Importance of Detail: How Differences in Ligand Structures Determine Distinct Functional Responses in Integrin α v β 3

article

The Interplay between Structural Stability and Plasticity Determines Mutation Profiles and Chaperone Dependence in Protein Kinases.

artículo científico publicado en 2017

Thiazinoquinones as New Promising Multistage Schistosomicidal Compounds Impacting Schistosoma mansoni and Egg Viability

artículo científico publicado en 2019