Auteur zoekresultaten

1

Molecular Dynamics Simulations of the NGF-TrkA Domain 5 Complex and Comparison with Biological Data door Settanni, Giovanni, Cattaneo, Antonino, Carloni, Paolo

Gepubliceerd in 2003

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cAMP Modulation of the Cytoplasmic Domain in the HCN2 Channel Investigated by Molecular Simulations door Berrera, Marco, Pantano, Sergio, Carloni, Paolo

Gepubliceerd in 2006

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Molecular Simulation of the Binding of Nerve Growth Factor Peptide Mimics to the Receptor Tyrosine Kinase A door Berrera, Marco, Cattaneo, Antonino, Carloni, Paolo

Gepubliceerd in 2006

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Protein design is a key factor for subunit–subunit association door Clementi, Cecilia, Carloni, Paolo, Maritan, Amos

Gepubliceerd in 1999

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Drug resistance in HIV-1 protease: Flexibility-assisted mechanism of compensatory mutations door Piana, Stefano, Carloni, Paolo, Rothlisberger, Ursula

Gepubliceerd in 2002

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DNA like-charge attraction and overcharging by divalent counterions in the presence of divalent co-ions door Nguyen, Viet Duc, Nguyen, Toan T., Carloni, Paolo

Gepubliceerd in 2017

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Understanding Ligand Binding to G-Protein Coupled Receptors Using Multiscale Simulations door Alfonso-Prieto, Mercedes, Navarini, Luciano, Carloni, Paolo

Gepubliceerd in 2019

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A structural model of agonist binding to the α3β4 neuronal nicotinic receptor door Costa, Valeria, Nistri, Andrea, Cavalli, Andrea, Carloni, Paolo

Gepubliceerd in 2003

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Mechanism of Action of Cyclophilin A Explored by Metadynamics Simulations door Leone, Vanessa, Lattanzi, Gianluca, Molteni, Carla, Carloni, Paolo

Gepubliceerd in 2009

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10

On the Zwitterionic Nature of Gas-Phase Peptides and Protein Ions door Marchese, Roberto, Grandori, Rita, Carloni, Paolo, Raugei, Simone

Gepubliceerd in 2010

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11

Coordination Numbers of K(+) and Na(+) Ions Inside the Selectivity Filter of the KcsA Potassium Channel: Insights from First Principles Molecular Dynamics door Bucher, Denis, Guidoni, Leonardo, Carloni, Paolo, Rothlisberger, Ursula

Gepubliceerd in 2010

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Advanced Computational Methods in Molecular Medicine door Giorgetti, Alejandro, Ruggerone, Paolo, Pantano, Sergio, Carloni, Paolo

Gepubliceerd in 2012

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13

Open-Boundary Molecular Mechanics/Coarse-Grained Framework for Simulations of Low-Resolution G-Protein-Coupled Receptor–Ligand Complexes door Tarenzi, Thomas, Calandrini, Vania, Potestio, Raffaello, Carloni, Paolo

Gepubliceerd in 2019

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Coevolutionary data-based interaction networks approach highlighting key residues across protein families: The case of the G-protein coupled receptors door Baldessari, Filippo, Capelli, Riccardo, Carloni, Paolo, Giorgetti, Alejandro

Gepubliceerd in 2020

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Sliding of Alkylating Anticancer Drugs along the Minor Groove of DNA: New Insights on Sequence Selectivity door Vargiu, Attilio V., Ruggerone, Paolo, Magistrato, Alessandra, Carloni, Paolo

Gepubliceerd in 2008

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Dissociation of minor groove binders from DNA: insights from metadynamics simulations door Vargiu, Attilio Vittorio, Ruggerone, Paolo, Magistrato, Alessandra, Carloni, Paolo

Gepubliceerd in 2008

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17

Structural Determinants of the Prion Protein N-Terminus and Its Adducts with Copper Ions door Sánchez-López, Carolina, Rossetti, Giulia, Quintanar, Liliana, Carloni, Paolo

Gepubliceerd in 2018

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18

Role and Perspective of Molecular Simulation-Based Investigation of RNA–Ligand Interaction: From Small Molecules and Peptides to Photoswitchable RNA Binding door Berdnikova, Daria V., Carloni, Paolo, Krauß, Sybille, Rossetti, Giulia

Gepubliceerd in 2021

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19

Role of protein frame and solvent for the redox properties of azurin from Pseudomonas aeruginosa door Cascella, Michele, Magistrato, Alessandra, Tavernelli, Ivano, Carloni, Paolo, Rothlisberger, Ursula

Gepubliceerd in 2006

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20

Engineered human angiogenin mutations in the placental ribonuclease inhibitor complex for anticancer therapy: Insights from enhanced sampling simulations door Cong, Xiaojing, Cremer, Christian, Nachreiner, Thomas, Barth, Stefan, Carloni, Paolo

Gepubliceerd in 2016

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Zoekresultaten - Carloni, Paolo

Molecular Dynamics Simulations of the NGF-TrkA Domain 5 Complex and Comparison with Biological Data door Settanni, Giovanni, Cattaneo, Antonino, Carloni, Paolo

cAMP Modulation of the Cytoplasmic Domain in the HCN2 Channel Investigated by Molecular Simulations door Berrera, Marco, Pantano, Sergio, Carloni, Paolo

Molecular Simulation of the Binding of Nerve Growth Factor Peptide Mimics to the Receptor Tyrosine Kinase A door Berrera, Marco, Cattaneo, Antonino, Carloni, Paolo

Protein design is a key factor for subunit–subunit association door Clementi, Cecilia, Carloni, Paolo, Maritan, Amos

Drug resistance in HIV-1 protease: Flexibility-assisted mechanism of compensatory mutations door Piana, Stefano, Carloni, Paolo, Rothlisberger, Ursula

DNA like-charge attraction and overcharging by divalent counterions in the presence of divalent co-ions door Nguyen, Viet Duc, Nguyen, Toan T., Carloni, Paolo

Understanding Ligand Binding to G-Protein Coupled Receptors Using Multiscale Simulations door Alfonso-Prieto, Mercedes, Navarini, Luciano, Carloni, Paolo

A structural model of agonist binding to the α3β4 neuronal nicotinic receptor door Costa, Valeria, Nistri, Andrea, Cavalli, Andrea, Carloni, Paolo

Mechanism of Action of Cyclophilin A Explored by Metadynamics Simulations door Leone, Vanessa, Lattanzi, Gianluca, Molteni, Carla, Carloni, Paolo

On the Zwitterionic Nature of Gas-Phase Peptides and Protein Ions door Marchese, Roberto, Grandori, Rita, Carloni, Paolo, Raugei, Simone

Coordination Numbers of K(+) and Na(+) Ions Inside the Selectivity Filter of the KcsA Potassium Channel: Insights from First Principles Molecular Dynamics door Bucher, Denis, Guidoni, Leonardo, Carloni, Paolo, Rothlisberger, Ursula

Advanced Computational Methods in Molecular Medicine door Giorgetti, Alejandro, Ruggerone, Paolo, Pantano, Sergio, Carloni, Paolo

Open-Boundary Molecular Mechanics/Coarse-Grained Framework for Simulations of Low-Resolution G-Protein-Coupled Receptor–Ligand Complexes door Tarenzi, Thomas, Calandrini, Vania, Potestio, Raffaello, Carloni, Paolo

Coevolutionary data-based interaction networks approach highlighting key residues across protein families: The case of the G-protein coupled receptors door Baldessari, Filippo, Capelli, Riccardo, Carloni, Paolo, Giorgetti, Alejandro

Sliding of Alkylating Anticancer Drugs along the Minor Groove of DNA: New Insights on Sequence Selectivity door Vargiu, Attilio V., Ruggerone, Paolo, Magistrato, Alessandra, Carloni, Paolo

Dissociation of minor groove binders from DNA: insights from metadynamics simulations door Vargiu, Attilio Vittorio, Ruggerone, Paolo, Magistrato, Alessandra, Carloni, Paolo

Structural Determinants of the Prion Protein N-Terminus and Its Adducts with Copper Ions door Sánchez-López, Carolina, Rossetti, Giulia, Quintanar, Liliana, Carloni, Paolo

Role and Perspective of Molecular Simulation-Based Investigation of RNA–Ligand Interaction: From Small Molecules and Peptides to Photoswitchable RNA Binding door Berdnikova, Daria V., Carloni, Paolo, Krauß, Sybille, Rossetti, Giulia

Role of protein frame and solvent for the redox properties of azurin from Pseudomonas aeruginosa door Cascella, Michele, Magistrato, Alessandra, Tavernelli, Ivano, Carloni, Paolo, Rothlisberger, Ursula

Engineered human angiogenin mutations in the placental ribonuclease inhibitor complex for anticancer therapy: Insights from enhanced sampling simulations door Cong, Xiaojing, Cremer, Christian, Nachreiner, Thomas, Barth, Stefan, Carloni, Paolo

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