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October 5, 2016
A multi-resolution model to capture both global fluctuations of an enzyme and molecular recognition in the ligand-binding site
Aoife C Fogarty, Raffaello Potestio, Kurt Kremer
The Journal of Chemical Physics
|
February 3, 2017
Erratum: "Adaptive resolution simulation of a biomolecule and its hydration shell: Structural and dynamical properties" [J. Chem. Phys. 142, 195101 (2015)]
Aoife C Fogarty, Raffaello Potestio, Kurt Kremer
The Journal of Chemical Physics
|
September 23, 2021
Protein self-entanglement modulates successful folding to the native state: A multi-scale modeling study
Lorenzo Federico Signorini, Claudio Perego, Raffaello Potestio
The Journal of Chemical Physics
|
May 24, 2015
Adaptive resolution simulation of a biomolecule and its hydration shell: Structural and dynamical properties
Aoife C Fogarty, Raffaello Potestio, Kurt Kremer
International Journal of Molecular Sciences
|
April 28, 2023
Gamma-Hemolysin Components: Computational Strategies for LukF-Hlg2 Dimer Reconstruction on a Model Membrane
Costanza Paternoster, Thomas Tarenzi, Raffaello Potestio, et al.
Plos Computational Biology
|
March 30, 2012
Corresponding functional dynamics across the Hsp90 Chaperone family: insights from a multiscale analysis of MD simulations
Giulia Morra, Raffaello Potestio, Cristian Micheletti, et al.
Journal of Chemical Theory and Computation
|
November 19, 2015
Nuclear Quantum Effects in Water: A Multiscale Study
Sebastian Fritsch, Raffaello Potestio, Davide Donadio, et al.
Journal of Chemical Theory and Computation
|
February 15, 2019
Open-Boundary Molecular Mechanics/Coarse-Grained Framework for Simulations of Low-Resolution G-Protein-Coupled Receptor-Ligand Complexes
Thomas Tarenzi, Vania Calandrini, Raffaello Potestio, et al.
Journal of Chemical Theory and Computation
|
December 6, 2018
Optimal Coarse-Grained Site Selection in Elastic Network Models of Biomolecules
Patrick Diggins, Changjiang Liu, Markus Deserno, et al.
Biophysical Reports
|
November 2, 2025
Sequence and supercoiling-dependent effects on the structural dynamics of DNA minicircles
Manuel Micheloni, Luca Tubiana, Raffaello Potestio, et al.
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of 6
Search research articles
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Showing results (21-30 of 57) with videos related to
Sort By:
Page
of 6
Proteins
|
October 5, 2016
A multi-resolution model to capture both global fluctuations of an enzyme and molecular recognition in the ligand-binding site
Aoife C Fogarty, Raffaello Potestio, Kurt Kremer
The Journal of Chemical Physics
|
February 3, 2017
Erratum: "Adaptive resolution simulation of a biomolecule and its hydration shell: Structural and dynamical properties" [J. Chem. Phys. 142, 195101 (2015)]
Aoife C Fogarty, Raffaello Potestio, Kurt Kremer
The Journal of Chemical Physics
|
September 23, 2021
Protein self-entanglement modulates successful folding to the native state: A multi-scale modeling study
Lorenzo Federico Signorini, Claudio Perego, Raffaello Potestio
The Journal of Chemical Physics
|
May 24, 2015
Adaptive resolution simulation of a biomolecule and its hydration shell: Structural and dynamical properties
Aoife C Fogarty, Raffaello Potestio, Kurt Kremer
International Journal of Molecular Sciences
|
April 28, 2023
Gamma-Hemolysin Components: Computational Strategies for LukF-Hlg2 Dimer Reconstruction on a Model Membrane
Costanza Paternoster, Thomas Tarenzi, Raffaello Potestio, et al.
Plos Computational Biology
|
March 30, 2012
Corresponding functional dynamics across the Hsp90 Chaperone family: insights from a multiscale analysis of MD simulations
Giulia Morra, Raffaello Potestio, Cristian Micheletti, et al.
Journal of Chemical Theory and Computation
|
November 19, 2015
Nuclear Quantum Effects in Water: A Multiscale Study
Sebastian Fritsch, Raffaello Potestio, Davide Donadio, et al.
Journal of Chemical Theory and Computation
|
February 15, 2019
Open-Boundary Molecular Mechanics/Coarse-Grained Framework for Simulations of Low-Resolution G-Protein-Coupled Receptor-Ligand Complexes
Thomas Tarenzi, Vania Calandrini, Raffaello Potestio, et al.
Journal of Chemical Theory and Computation
|
December 6, 2018
Optimal Coarse-Grained Site Selection in Elastic Network Models of Biomolecules
Patrick Diggins, Changjiang Liu, Markus Deserno, et al.
Biophysical Reports
|
November 2, 2025
Sequence and supercoiling-dependent effects on the structural dynamics of DNA minicircles
Manuel Micheloni, Luca Tubiana, Raffaello Potestio, et al.
Page
of 6