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The Journal of Chemical Physics
|
April 15, 2026
Making excited state MD faster: Extrapolation of transition densities for TD-DFT calculations
Michele Nottoli, Damiano Castrignano', Patrizia Mazzeo, et al.
Annual Review of Physical Chemistry
|
February 9, 2021
Multiscale Models for Light-Driven Processes
Michele Nottoli, Lorenzo Cupellini, Filippo Lipparini, et al.
Physical Chemistry Chemical Physics : PCCP
|
June 27, 2020
Polarizable embedding QM/MM: the future gold standard for complex (bio)systems?
Mattia Bondanza, Michele Nottoli, Lorenzo Cupellini, et al.
Journal of Chemical Theory and Computation
|
March 8, 2022
Molecular Dynamics Simulations Enforcing Nonperiodic Boundary Conditions: New Developments and Application to the Solvent Shifts of Nitroxide Magnetic Parameters
Giordano Mancini, Marco Fusè, Filippo Lipparini, et al.
Chemical Science
|
November 15, 2021
From crystallographic data to the solution structure of photoreceptors: the case of the AppA BLUF domain
Shaima Hashem, Veronica Macaluso, Michele Nottoli, et al.
The Journal of Physical Chemistry. B
|
September 3, 2021
Ultrafast Transient Infrared Spectroscopy of Photoreceptors with Polarizable QM/MM Dynamics
Veronica Macaluso, Shaima Hashem, Michele Nottoli, et al.
The Journal of Physical Chemistry Letters
|
July 30, 2024
Importance of Polarizable Embedding for Computing Optical Rotation: The Case of Camphor in Ethanol
Michele Nottoli, Edoardo Vanich, Lorenzo Cupellini, et al.
The Journal of Chemical Physics
|
April 1, 2024
The OpenMMPol library for polarizable QM/MM calculations of properties and dynamics
Mattia Bondanza, Tommaso Nottoli, Michele Nottoli, et al.
Photosynthesis Research
|
March 5, 2018
The role of charge-transfer states in the spectral tuning of antenna complexes of purple bacteria
Michele Nottoli, Sandro Jurinovich, Lorenzo Cupellini, et al.
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of 2
Search research articles
Search
Showing results (11-20 of 19) with videos related to
Sort By:
Page
of 2
You have reached the last page of results.
This site can display upto 19 results.
The Journal of Chemical Physics
|
April 15, 2026
Making excited state MD faster: Extrapolation of transition densities for TD-DFT calculations
Michele Nottoli, Damiano Castrignano', Patrizia Mazzeo, et al.
Annual Review of Physical Chemistry
|
February 9, 2021
Multiscale Models for Light-Driven Processes
Michele Nottoli, Lorenzo Cupellini, Filippo Lipparini, et al.
Physical Chemistry Chemical Physics : PCCP
|
June 27, 2020
Polarizable embedding QM/MM: the future gold standard for complex (bio)systems?
Mattia Bondanza, Michele Nottoli, Lorenzo Cupellini, et al.
Journal of Chemical Theory and Computation
|
March 8, 2022
Molecular Dynamics Simulations Enforcing Nonperiodic Boundary Conditions: New Developments and Application to the Solvent Shifts of Nitroxide Magnetic Parameters
Giordano Mancini, Marco Fusè, Filippo Lipparini, et al.
Chemical Science
|
November 15, 2021
From crystallographic data to the solution structure of photoreceptors: the case of the AppA BLUF domain
Shaima Hashem, Veronica Macaluso, Michele Nottoli, et al.
The Journal of Physical Chemistry. B
|
September 3, 2021
Ultrafast Transient Infrared Spectroscopy of Photoreceptors with Polarizable QM/MM Dynamics
Veronica Macaluso, Shaima Hashem, Michele Nottoli, et al.
The Journal of Physical Chemistry Letters
|
July 30, 2024
Importance of Polarizable Embedding for Computing Optical Rotation: The Case of Camphor in Ethanol
Michele Nottoli, Edoardo Vanich, Lorenzo Cupellini, et al.
The Journal of Chemical Physics
|
April 1, 2024
The OpenMMPol library for polarizable QM/MM calculations of properties and dynamics
Mattia Bondanza, Tommaso Nottoli, Michele Nottoli, et al.
Photosynthesis Research
|
March 5, 2018
The role of charge-transfer states in the spectral tuning of antenna complexes of purple bacteria
Michele Nottoli, Sandro Jurinovich, Lorenzo Cupellini, et al.
Page
of 2