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Physical Chemistry Chemical Physics : PCCP
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December 14, 2011
A general theoretical model for electron transfer reactions in complex systems
Andrea Amadei, Isabella Daidone, Massimiliano Aschi
Journal of Molecular Biology
|
May 19, 2004
Investigating the accessibility of the closed domain conformation of citrate synthase using essential dynamics sampling
Isabella Daidone, Danilo Roccatano, Steven Hayward
Journal of Computational Chemistry
|
June 20, 2025
Revisiting the "Cluster-In-Solvent" Approach for Computational Spectroscopy: The Vibrational Circular Dichroism as a Test Case
Srilatha Arra, Isabella Daidone, Massimiliano Aschi
Journal of the American Chemical Society
|
November 19, 2009
Common folding mechanism of a beta-hairpin peptide via non-native turn formation revealed by unbiased molecular dynamics simulations
Lipi Thukral, Jeremy C Smith, Isabella Daidone
The Journal of Physical Chemistry Letters
|
March 12, 2019
Evidence of a Thermodynamic Ramp for Hole Hopping to Protect a Redox Enzyme from Oxidative Damage
Laura Zanetti-Polzi, Isabella Daidone, Stefano Corni
Plos Computational Biology
|
September 21, 2011
Structured pathway across the transition state for peptide folding revealed by molecular dynamics simulations
Lipi Thukral, Isabella Daidone, Jeremy C Smith
Biopolymers
|
November 5, 2004
A molecular dynamics study of acylphosphatase in aggregation-promoting conditions: the influence of trifluoroethanol/water solvent
Dagmar Flöck, Isabella Daidone, Alfredo Di Nola
Physical Chemistry Chemical Physics : PCCP
|
August 29, 2020
Cooperative protein-solvent tuning of proton transfer energetics: carbonic anhydrase as a case study
Laura Zanetti-Polzi, Massimiliano Aschi, Isabella Daidone
The Journal of Physical Chemistry Letters
|
September 7, 2021
High Water Density at Non-Ice-Binding Surfaces Contributes to the Hyperactivity of Antifreeze Proteins
Akash Deep Biswas, Vincenzo Barone, Isabella Daidone
The Journal of Physical Chemistry. B
|
May 20, 2020
Fully Atomistic Multiscale Approach for p<i>K</i><sub></sub> Prediction
Laura Zanetti-Polzi, Isabella Daidone, Andrea Amadei
Page
of 10
Search research articles
Search
Showing results (1-10 of 93) with videos related to
Sort By:
Page
of 10
Physical Chemistry Chemical Physics : PCCP
|
December 14, 2011
A general theoretical model for electron transfer reactions in complex systems
Andrea Amadei, Isabella Daidone, Massimiliano Aschi
Journal of Molecular Biology
|
May 19, 2004
Investigating the accessibility of the closed domain conformation of citrate synthase using essential dynamics sampling
Isabella Daidone, Danilo Roccatano, Steven Hayward
Journal of Computational Chemistry
|
June 20, 2025
Revisiting the "Cluster-In-Solvent" Approach for Computational Spectroscopy: The Vibrational Circular Dichroism as a Test Case
Srilatha Arra, Isabella Daidone, Massimiliano Aschi
Journal of the American Chemical Society
|
November 19, 2009
Common folding mechanism of a beta-hairpin peptide via non-native turn formation revealed by unbiased molecular dynamics simulations
Lipi Thukral, Jeremy C Smith, Isabella Daidone
The Journal of Physical Chemistry Letters
|
March 12, 2019
Evidence of a Thermodynamic Ramp for Hole Hopping to Protect a Redox Enzyme from Oxidative Damage
Laura Zanetti-Polzi, Isabella Daidone, Stefano Corni
Plos Computational Biology
|
September 21, 2011
Structured pathway across the transition state for peptide folding revealed by molecular dynamics simulations
Lipi Thukral, Isabella Daidone, Jeremy C Smith
Biopolymers
|
November 5, 2004
A molecular dynamics study of acylphosphatase in aggregation-promoting conditions: the influence of trifluoroethanol/water solvent
Dagmar Flöck, Isabella Daidone, Alfredo Di Nola
Physical Chemistry Chemical Physics : PCCP
|
August 29, 2020
Cooperative protein-solvent tuning of proton transfer energetics: carbonic anhydrase as a case study
Laura Zanetti-Polzi, Massimiliano Aschi, Isabella Daidone
The Journal of Physical Chemistry Letters
|
September 7, 2021
High Water Density at Non-Ice-Binding Surfaces Contributes to the Hyperactivity of Antifreeze Proteins
Akash Deep Biswas, Vincenzo Barone, Isabella Daidone
The Journal of Physical Chemistry. B
|
May 20, 2020
Fully Atomistic Multiscale Approach for p<i>K</i><sub></sub> Prediction
Laura Zanetti-Polzi, Isabella Daidone, Andrea Amadei
Page
of 10