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Disambiguation of "Carloni, Paolo"

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Exhaustive search of ligand binding pathways via volume-based metadynamics

, , and . The journal of physical chemistry letters, 10 (12): 3495--3499 (2019)

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Olivier Carloni

Giordano Paolo

Paolo Molteni

Paolo Bavaj

Paolo Fornara

 

Other publications of authors with the same name

Exhaustive search of ligand binding pathways via volume-based metadynamics, , and . The journal of physical chemistry letters, 10 (12): 3495--3499 (2019)Parameterization of azole-bridged dinuclear platinum anticancer drugs via a QM/MM force matching procedure., , , , , , , and . J. Comput. Chem., 29 (1): 38-49 (2008)Molecular motions in drug design: the coming age of the metadynamics method., , , , and . J. Comput. Aided Mol. Des., 25 (5): 395-402 (2011)On the nature of the reaction intermediate in the HIV-1 protease: a quantum chemical study., , , and . Comput. Phys. Commun., 179 (1-3): 120-123 (2008)Ligand Pose Predictions for Human G Protein-Coupled Receptors: Insights from the Amber-Based Hybrid Molecular Mechanics/Coarse-Grained Approach., , , , , and . J. Chem. Inf. Model., 60 (10): 5103-5116 (2020)Molecular Simulation-Based Structural Prediction of Protein Complexes in Mass Spectrometry: The Human Insulin Dimer., , , , , , and . PLoS Comput. Biol., (2014)Regulation of adenylyl cyclase 5 in striatal neurons confers the ability to detect coincident neuromodulatory signals., , , , , , , , and . PLoS Comput. Biol., (2019)Unbinding kinetics of a p38 MAP kinase type II inhibitor from metadynamics simulations, , , , and . Journal of the American Chemical Society, (2017)PMID: 28290199.Unifying view of mechanical and functional hotspots across class A GPCRs., , , , , and . PLoS Comput. Biol., (2017)On the Zwitterionic Nature of Gas-Phase Peptides and Protein Ions., , , and . PLoS Comput. Biol., (2010)