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Riccardo Capelli

Showing results (31-40 of 54) with videos related to

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The Journal of Chemical Physics|January 16, 2022
Automatic multi-objective optimization of coarse-grained lipid force fields using SwarmCGCharly Empereur-Mot, Riccardo Capelli, Mattia Perrone, et al.
Chemical Science|December 15, 2023
Self-assembly of cyclic peptide monolayers by hydrophobic supramolecular hingesIgnacio Insua, Annalisa Cardellini, Sandra Díaz, et al.
ACS Omega|December 30, 2020
<i>Swarm-CG</i>: Automatic Parametrization of Bonded Terms in MARTINI-Based Coarse-Grained Models of Simple to Complex Molecules <i>via</i> Fuzzy Self-Tuning Particle Swarm OptimizationCharly Empereur-Mot, Luca Pesce, Giovanni Doni, et al.
ACS Omega|September 5, 2022
Well-Tempered Metadynamics Simulations Predict the Structural and Dynamic Properties of a Chiral 24-Atom Macrocycle in SolutionRiccardo Capelli, Alexander J Menke, Hongjun Pan, et al.
Biology Direct|June 6, 2025
Affibodies as valuable tool to prevent β<sub>2</sub>m aggregation under lysosomal-like conditionsCristina Visentin, Giulia Rizzi, Wen Yin, et al.
Amyloid : the International Journal of Experimental and Clinical Investigation : the Official Journal of the International Society of Amyloidosis|January 19, 2026
Electric field-induced destabilization and surface modulation of Aβ42 fibrils in molecular simulations: theoretical implications for direct current stimulation in Alzheimer's diseaseFran Bačić Toplek, Natale Vincenzo Maiorana, Matteo Guidetti, et al.
Journal of Chemical Information and Modeling|December 31, 2024
Estimation of Ligand Binding Free Energy Using Multi-eGOBruno Stegani, Emanuele Scalone, Fran Bačić Toplek, et al.
The Journal of Physical Chemistry Letters|July 17, 2020
Accuracy of Molecular Simulation-Based Predictions of <i>k</i><sub>off</sub> Values: A Metadynamics StudyRiccardo Capelli, Wenping Lyu, Viacheslav Bolnykh, et al.
The Journal of Organic Chemistry|February 1, 2024
Proton Affinity and Conformational Integrity of a 24-Atom Triazine Macrocycle across Physiologically Relevant pHAlexander J Menke, Zachary P Jacobus, Liam E Claton, et al.
Frontiers in Cell and Developmental Biology|May 13, 2022
Multiple Poses and Thermodynamics of Ligands Targeting Protein Surfaces: The Case of Furosemide Binding to mitoNEET in Aqueous SolutionLinh Gia Hoang, Jonas Goßen, Riccardo Capelli, et al.
Pageof 6

Showing results (31-40 of 54) with videos related to

Sort By:
Pageof 6
The Journal of Chemical Physics|January 16, 2022
Automatic multi-objective optimization of coarse-grained lipid force fields using SwarmCGCharly Empereur-Mot, Riccardo Capelli, Mattia Perrone, et al.
Chemical Science|December 15, 2023
Self-assembly of cyclic peptide monolayers by hydrophobic supramolecular hingesIgnacio Insua, Annalisa Cardellini, Sandra Díaz, et al.
ACS Omega|December 30, 2020
<i>Swarm-CG</i>: Automatic Parametrization of Bonded Terms in MARTINI-Based Coarse-Grained Models of Simple to Complex Molecules <i>via</i> Fuzzy Self-Tuning Particle Swarm OptimizationCharly Empereur-Mot, Luca Pesce, Giovanni Doni, et al.
ACS Omega|September 5, 2022
Well-Tempered Metadynamics Simulations Predict the Structural and Dynamic Properties of a Chiral 24-Atom Macrocycle in SolutionRiccardo Capelli, Alexander J Menke, Hongjun Pan, et al.
Biology Direct|June 6, 2025
Affibodies as valuable tool to prevent β<sub>2</sub>m aggregation under lysosomal-like conditionsCristina Visentin, Giulia Rizzi, Wen Yin, et al.
Amyloid : the International Journal of Experimental and Clinical Investigation : the Official Journal of the International Society of Amyloidosis|January 19, 2026
Electric field-induced destabilization and surface modulation of Aβ42 fibrils in molecular simulations: theoretical implications for direct current stimulation in Alzheimer's diseaseFran Bačić Toplek, Natale Vincenzo Maiorana, Matteo Guidetti, et al.
Journal of Chemical Information and Modeling|December 31, 2024
Estimation of Ligand Binding Free Energy Using Multi-eGOBruno Stegani, Emanuele Scalone, Fran Bačić Toplek, et al.
The Journal of Physical Chemistry Letters|July 17, 2020
Accuracy of Molecular Simulation-Based Predictions of <i>k</i><sub>off</sub> Values: A Metadynamics StudyRiccardo Capelli, Wenping Lyu, Viacheslav Bolnykh, et al.
The Journal of Organic Chemistry|February 1, 2024
Proton Affinity and Conformational Integrity of a 24-Atom Triazine Macrocycle across Physiologically Relevant pHAlexander J Menke, Zachary P Jacobus, Liam E Claton, et al.
Frontiers in Cell and Developmental Biology|May 13, 2022
Multiple Poses and Thermodynamics of Ligands Targeting Protein Surfaces: The Case of Furosemide Binding to mitoNEET in Aqueous SolutionLinh Gia Hoang, Jonas Goßen, Riccardo Capelli, et al.
Pageof 6