Showing results (1-10 of 9) with videos related to
Sort By:
Pageof 1
Scientific Reports|August 14, 2020
The control of acidity in tumor cells: a biophysical modelNicola Piasentin, Edoardo Milotti, Roberto ChignolaACS Omega|January 5, 2022
Evaluation of Constrained and Restrained Molecular Dynamics Simulation Methods for Predicting Skin Lipid PermeabilityNicola Piasentin, Guoping Lian, Qiong CaiThe Journal of Physical Chemistry. B|March 17, 2023
In Silico Prediction of Stratum Corneum Partition Coefficients via COSMOmic and Molecular Dynamics SimulationsNicola Piasentin, Guoping Lian, Qiong CaiJournal of Chemical Theory and Computation|July 28, 2025
Enhanced Sampling and Tailored Collective Variables Yield Reproducible Free Energy Landscapes of Beta-1 Adrenergic Receptor ActivationSimone Aureli, Valerio Rizzi, Nicola Piasentin, et al.The Journal of Physical Chemistry Letters|March 3, 2026
A Transferable and Robust Computational Framework for Class A GPCR Activation Free EnergiesSimone Aureli, Nicola Piasentin, Thorben Fröhlking, et al.Toxicology in Vitro : an International Journal Published in Association with BIBRA|September 28, 2023
An examination of published datasets of skin permeability and partition coefficientsBenjamin N Deacon, Nicola Piasentin, Qiong Cai, et al.The Journal of Physical Chemistry Letters|September 8, 2025
The Arch from the Stones: Understanding Protein Folding Energy Landscapes via Bioinspired Collective VariablesValerio Rizzi, Margaux Héritier, Nicola Piasentin, et al.The Journal of Chemical Physics|October 23, 2025
All you need is water: Converging ligand binding simulations with hydration collective variablesMarc Schulze, Tetiana Khakhula, Nicola Piasentin, et al.Biorxiv : the Preprint Server for Biology|February 6, 2026
Molecular basis of mitogen-activated protein kinase ERK2 activation by its upstream kinase MEK1Jill von Velsen, Pauline Juyoux, Nicola Piasentin, et al.Pageof 1