Giorgio Colombo
Orcid: 0000-0002-1318-668XAffiliations:
- Istituto di Chimica del Riconoscimento Molecolare, Milano, Italy
According to our database1,
Giorgio Colombo
authored at least 22 papers
between 2001 and 2023.
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Bibliography
2023
Integrating Protein Interaction Surface Prediction with a Fragment-Based Drug Design: Automatic Design of New Leads with Fragments on Energy Surfaces.
J. Chem. Inf. Model., 2023
2021
SARS-CoV-2 Spike Protein Mutations and Escape from Antibodies: A Computational Model of Epitope Loss in Variants of Concern.
J. Chem. Inf. Model., 2021
2020
J. Chem. Inf. Model., 2020
2019
Impact of Mutations on NPAC Structural Dynamics: Mechanistic Insights from MD Simulations.
J. Chem. Inf. Model., 2019
Proceedings of the Numerical Computations: Theory and Algorithms, 2019
2017
High Affinity vs. Native Fibronectin in the Modulation of αvβ3 Integrin Conformational Dynamics: Insights from Computational Analyses and Implications for Molecular Design.
PLoS Comput. Biol., 2017
Unraveling Energy and Dynamics Determinants to Interpret Protein Functional Plasticity: The Limonene-1, 2-epoxide-hydrolase Case Study.
J. Chem. Inf. Model., 2017
SAGE: A Fast Computational Tool for Linear Epitope Grafting onto a Foreign Protein Scaffold.
J. Chem. Inf. Model., 2017
2016
Structure-based approach for identification of novel phenylboronic acids as serine-β-lactamase inhibitors.
J. Comput. Aided Mol. Des., 2016
2015
Structural Stability and Flexibility Direct the Selection of Activating Mutations in Epidermal Growth Factor Receptor Kinase.
J. Chem. Inf. Model., 2015
J. Comput. Aided Mol. Des., 2015
2014
Computational Approaches Elucidate the Allosteric Mechanism of Human Aromatase Inhibition: A Novel Possible Route to Small-Molecule Regulation of CYP450s Activities?
J. Chem. Inf. Model., 2014
Exploiting Conformational Dynamics in Drug Discovery: Design of C-Terminal Inhibitors of Hsp90 with Improved Activities.
J. Chem. Inf. Model., 2014
2013
Energetic and Dynamic Aspects of the Affinity Maturation Process: Characterizing Improved Variants from the Bevacizumab Antibody with Molecular Simulations.
J. Chem. Inf. Model., 2013
2012
Corresponding Functional Dynamics across the Hsp90 Chaperone Family: Insights from a Multiscale Analysis of MD Simulations.
PLoS Comput. Biol., 2012
Molecular Mechanism of Allosteric Communication in Hsp70 Revealed by Molecular Dynamics Simulations.
PLoS Comput. Biol., 2012
2011
A Multiscale Approach to Characterize the Early Aggregation Steps of the Amyloid-Forming Peptide GNNQQNY from the Yeast Prion Sup-35.
PLoS Comput. Biol., 2011
2009
Modeling Signal Propagation Mechanisms and Ligand-Based Conformational Dynamics of the Hsp90 Molecular Chaperone Full-Length Dimer.
PLoS Comput. Biol., 2009
2008
Molecular simulation of multistate peptide dynamics: A comparison between microsecond timescale sampling and multiple shorter trajectories.
J. Comput. Chem., 2008
2007
Ab initio protein structure prediction with a dipeptide-assembly evolutionary algorithm.
Proceedings of the Genetic and Evolutionary Computation Conference, 2007
2005
A decoy set for the thermostable subdomain from chicken villin headpiece, comparison of different free energy estimators.
BMC Bioinform., 2005
2001
Simulation of carbohydrate-protein interactions: Computer-aided design of a second generation GM1 mimic.
J. Comput. Aided Mol. Des., 2001