Marco Mor

Orcid: 0000-0003-0199-1849

According to our database1, Marco Mor authored at least 10 papers between 2013 and 2023.

Collaborative distances:
  • Dijkstra number2 of five.
  • Erdős number3 of five.

Timeline

Legend:

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Online presence:

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Bibliography

2023
Molecular Determinants of EphA2 and EphB2 Antagonism Enable the Design of Ligands with Improved Selectivity.
J. Chem. Inf. Model., November, 2023

Unbinding Kinetics of Muscarinic M3 Receptor Antagonists Explained by Metadynamics Simulations.
J. Chem. Inf. Model., May, 2023

Mechanistic Modeling of Lys745 Sulfonylation in EGFR C797S Reveals Chemical Determinants for Inhibitor Activity and Discriminates Reversible from Irreversible Agents.
J. Chem. Inf. Model., February, 2023

2022
Mechanistic Modeling of Monoglyceride Lipase Covalent Modification Elucidates the Role of Leaving Group Expulsion and Discriminates Inhibitors with High and Low Potency.
J. Chem. Inf. Model., 2022

Free-Energy Simulations Support a Lipophilic Binding Route for Melatonin Receptors.
J. Chem. Inf. Model., 2022

2017
Correction to Metadynamics Simulations Distinguish Short- and Long-Residence-Time Inhibitors of Cyclin-Dependent Kinase 8.
J. Chem. Inf. Model., 2017

Metadynamics Simulations Distinguish Short- and Long-Residence-Time Inhibitors of Cyclin-Dependent Kinase 8.
J. Chem. Inf. Model., 2017

2015
Quantum Mechanics/Molecular Mechanics Modeling of Covalent Addition between EGFR-Cysteine 797 and <i>N</i>-(4-Anilinoquinazolin-6-yl) Acrylamide.
J. Chem. Inf. Model., 2015

2014
Combining Ligand- and Structure-Based Approaches for the Discovery of New Inhibitors of the EPHA2-ephrin-A1 Interaction.
J. Chem. Inf. Model., 2014

2013
Structure-Based Virtual Screening of MT<sub>2</sub> Melatonin Receptor: Influence of Template Choice and Structural Refinement.
J. Chem. Inf. Model., 2013


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