Francesco Luigi Gervasio
University College London
H-index: 54
Europe-United Kingdom
Top articles of Francesco Luigi Gervasio
Title | Journal | Author(s) | Publication Date |
|---|---|---|---|
Drug-resistant EGFR lung cancer mutations promote tumor growth by stabilizing interfaces in ligand-free signaling-competent EGFR oligomers | Biophysical Journal | Sarah R Needham Sumanth Iyer Benjamin M Davis Ioannis Galdadas Selene K Roberts | 2024/2/8 |
Addressing Suboptimal Poses in Nonequilibrium Alchemical Calculations | The Journal of Physical Chemistry B | Maurice Karrenbrock Valerio Rizzi Piero Procacci Francesco Luigi Gervasio | 2024/2/7 |
Deep learning path-like collective variable for enhanced sampling molecular dynamics | arXiv preprint arXiv:2402.01508 | Thorben Fröhlking Luigi Bonati Valerio Rizzi Francesco Luigi Gervasio | 2024/2/2 |
Drug-resistant EGFR mutations promote lung cancer by stabilizing interfaces in ligand-free kinase-active EGFR oligomers | Nature Communications | R Sumanth Iyer Sarah R Needham Ioannis Galdadas Benjamin M Davis Selene K Roberts | 2024/3/19 |
Determinants of Neutral Antagonism and Inverse Agonism in the β2-Adrenergic Receptor | Journal of Chemical Information and Modeling | Jacqueline C Calderón Passainte Ibrahim Dorothea Gobbo Francesco Luigi Gervasio Timothy Clark | 2024/3/6 |
SWISH-X, an expanded approach to detect cryptic pockets in proteins and at protein-protein interfaces | bioRxiv | Alberto Borsatto Eleonora Gianquinto Valerio Rizzi Francesco Luigi Gervasio | 2023/11/5 |
The action of physiological and synthetic steroids on the calcium channel CatSper in human sperm | Frontiers in Cell and Developmental Biology | Lydia Wehrli Ioannis Galdadas Lionel Voirol Martin Smieško Yves Cambet | 2023/7/20 |
Activation/Deactivation Free-Energy Profiles for the β2-Adrenergic Receptor: Ligand Modes of Action | Journal of Chemical Information and Modeling | Jacqueline C Calderón Passainte Ibrahim Dorothea Gobbo Francesco Luigi Gervasio Timothy Clark | 2023/10/12 |
The T766M-EGFR lung cancer mutation promotes tumor growth by exploiting newfound mechanisms assembling ligand-free EGFR oligomer structures | bioRxiv | R Sumanth Iyer Sarah R Needham Ioannis Galdadas Benjamin M Davis Selene K Roberts | 2023/6/19 |
Architecture of the MKK6-p38α complex defines the basis of MAPK specificity and activation | Science | Pauline Juyoux Ioannis Galdadas Dorothea Gobbo Jill von Velsen Martin Pelosse | 2023/9/15 |
General Metadynamics Protocol To Simulate Activation/Deactivation of Class A GPCRs: Proof of Principle for the Serotonin Receptor | Journal of Chemical Information and Modeling | Jacqueline C Calderón Passainte Ibrahim Dorothea Gobbo Francesco Luigi Gervasio Timothy Clark | 2023/5/10 |
Extended Metadynamics Protocol for Binding/Unbinding Free Energies of Peptide Ligands to Class A G-Protein-Coupled Receptors | Journal of Chemical Information and Modeling | Jacqueline C Calderón Eva Plut Max Keller Chiara Cabrele Oliver Reiser | 2023/12/27 |
Subcellular location defines GPCR signal transduction | Science Advances | Arthur Radoux-Mergault Lucie Oberhauser Simone Aureli Francesco Luigi Gervasio Miriam Stoeber | 2023/4/19 |
OneOPES, a Combined Enhanced Sampling Method to Rule Them All | Journal of Chemical Theory and Computation | Valerio Rizzi Simone Aureli Narjes Ansari Francesco Luigi Gervasio | 2023/8/21 |
Structural basis of connexin-36 gap junction channel inhibition | bioRxiv | Xinyue Ding Simone Aureli Anand Vaithia Pia Lavriha Dina Schuster | 2023/12/9 |
A nonequilibrium alchemical method for drug-receptor absolute binding free energy calculations: the role of restraints | Maurice Karrenbrock Piero Procacci Francesco Luigi Gervasio | 2023/2/28 | |
Structure of the connexin-43 gap junction channel in a putative closed state | Elife | Chao Qi Silvia Acosta Gutierrez Pia Lavriha Alaa Othman Diego Lopez-Pigozzi | 2023/8/3 |
Revealing druggable cryptic pockets in the Nsp1 of SARS-CoV-2 and other β-coronaviruses by simulations and crystallography | Elife | Alberto Borsatto Obaeda Akkad Ioannis Galdadas Shumeng Ma Shymaa Damfo | 2022/11/22 |
Open Binding Pose Metadynamics: An Effective Approach for the Ranking of Protein–Ligand Binding Poses | Journal of Chemical Information and Modeling | Dominykas Lukauskis Marley L Samways Simone Aureli Benjamin P Cossins Richard D Taylor | 2022/11/19 |
Design, synthesis, and anticancer activity of a selenium-containing galectin-3 and galectin-9N inhibitor | International Journal of Molecular Sciences | Sonia Di Gaetano Luciano Pirone Ioannis Galdadas Serena Traboni Alfonso Iadonisi | 2022/2/25 |
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