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The Journal of Physical Chemistry. B
|
June 30, 2025
Binding Free Energy Calculations Based on the Path Collective Variable along a String Pathway
Alessia Ghidini, Andrea Cavalli, Benoît Roux
Accounts of Chemical Research
|
October 10, 2025
On Free Energy Calculations in Drug Discovery
Alessia Ghidini, Eleonora Serra, Andrea Cavalli
The Journal of Chemical Physics
|
February 10, 2026
A theoretical framework for random acceleration molecular dynamics simulations
Yiwei Ding, Alessia Ghidini, Pilar Cossio, et al.
Journal of Chemical Theory and Computation
|
February 5, 2025
Nonequilibrium Binding Free Energy Simulations: Minimizing Dissipation
Eleonora Serra, Alessia Ghidini, Sergio Decherchi, et al.
Molecules (Basel, Switzerland)
|
October 27, 2022
PacDOCK: A Web Server for Positional Distance-Based and Interaction-Based Analysis of Docking Results
Jacopo Carbone, Alessia Ghidini, Antonio Romano, et al.
Journal of Chemical Information and Modeling
|
June 6, 2025
Path-Based Nonequilibrium Binding Free Energy Estimation, from Protein-Ligand to RNA-Ligand Binding
Eleonora Serra, Alessia Ghidini, Riccardo Aguti, et al.
International Journal of Molecular Sciences
|
June 10, 2023
Design, Pharmacological Characterization, and Molecular Docking of Minimalist Peptidomimetic Antagonists of α<sub>4</sub>β<sub>1</sub> Integrin
Monica Baiula, Michele Anselmi, Francesco Musiani, et al.
International Journal of Molecular Sciences
|
October 27, 2022
Synthesis, Biological Activity and Molecular Docking of Chimeric Peptides Targeting Opioid and NOP Receptors
Karol Wtorek, Alessia Ghidini, Luca Gentilucci, et al.
Page
of 1
Search research articles
Search
Showing results (1-10 of 8) with videos related to
Sort By:
Page
of 1
The Journal of Physical Chemistry. B
|
June 30, 2025
Binding Free Energy Calculations Based on the Path Collective Variable along a String Pathway
Alessia Ghidini, Andrea Cavalli, Benoît Roux
Accounts of Chemical Research
|
October 10, 2025
On Free Energy Calculations in Drug Discovery
Alessia Ghidini, Eleonora Serra, Andrea Cavalli
The Journal of Chemical Physics
|
February 10, 2026
A theoretical framework for random acceleration molecular dynamics simulations
Yiwei Ding, Alessia Ghidini, Pilar Cossio, et al.
Journal of Chemical Theory and Computation
|
February 5, 2025
Nonequilibrium Binding Free Energy Simulations: Minimizing Dissipation
Eleonora Serra, Alessia Ghidini, Sergio Decherchi, et al.
Molecules (Basel, Switzerland)
|
October 27, 2022
PacDOCK: A Web Server for Positional Distance-Based and Interaction-Based Analysis of Docking Results
Jacopo Carbone, Alessia Ghidini, Antonio Romano, et al.
Journal of Chemical Information and Modeling
|
June 6, 2025
Path-Based Nonequilibrium Binding Free Energy Estimation, from Protein-Ligand to RNA-Ligand Binding
Eleonora Serra, Alessia Ghidini, Riccardo Aguti, et al.
International Journal of Molecular Sciences
|
June 10, 2023
Design, Pharmacological Characterization, and Molecular Docking of Minimalist Peptidomimetic Antagonists of α<sub>4</sub>β<sub>1</sub> Integrin
Monica Baiula, Michele Anselmi, Francesco Musiani, et al.
International Journal of Molecular Sciences
|
October 27, 2022
Synthesis, Biological Activity and Molecular Docking of Chimeric Peptides Targeting Opioid and NOP Receptors
Karol Wtorek, Alessia Ghidini, Luca Gentilucci, et al.
Page
of 1