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Journal of Computational Chemistry
|
December 15, 2018
Using density based indexes to characterize excited states evolution
Federica Maschietto, Juan Sanz García, Marco Campetella, et al.
The Journal of Physical Chemistry. A
|
December 13, 2017
Using Density Based Indexes and Wave Function Methods for the Description of Excited States: Excited State Proton Transfer Reactions as a Test Case
Juan Sanz García, Federica Maschietto, Marco Campetella, et al.
The Journal of Chemical Physics
|
June 5, 2023
MDiGest: A Python package for describing allostery from molecular dynamics simulations
Federica Maschietto, Brandon Allen, Gregory W Kyro, et al.
The Journal of Chemical Physics
|
July 9, 2021
Chasing unphysical TD-DFT excited states in transition metal complexes with a simple diagnostic tool
Federica Maschietto, Marco Campetella, Juan Sanz García, et al.
Journal of Molecular Biology
|
March 27, 2022
MptpA Kinetics Enhanced by Allosteric Control of an Active Conformation
Federica Maschietto, Erik Zavala, Brandon Allen, et al.
Biophysical Journal
|
December 5, 2021
Distinct allosteric pathways in imidazole glycerol phosphate synthase from yeast and bacteria
Federica Maschietto, Aria Gheeraert, Andrea Piazzi, et al.
PNAS Nexus
|
May 1, 2024
Kernel-elastic autoencoder for molecular design
Haote Li, Yu Shee, Brandon Allen, et al.
Journal of Computational Chemistry
|
August 2, 2017
Charge transfer excitations in TDDFT: A ghost-hunter index
Marco Campetella, Federica Maschietto, Mike J Frisch, et al.
Journal of Computational Chemistry
|
January 12, 2018
How are the charge transfer descriptors affected by the quality of the underpinning electronic density?
Federica Maschietto, Marco Campetella, Michael J Frisch, et al.
Nature Communications
|
June 28, 2020
Rationally designed ruthenium complexes for 1- and 2-photon photodynamic therapy
Johannes Karges, Shi Kuang, Federica Maschietto, et al.
Page
of 3
Search research articles
Search
Showing results (1-10 of 29) with videos related to
Sort By:
Page
of 3
Journal of Computational Chemistry
|
December 15, 2018
Using density based indexes to characterize excited states evolution
Federica Maschietto, Juan Sanz García, Marco Campetella, et al.
The Journal of Physical Chemistry. A
|
December 13, 2017
Using Density Based Indexes and Wave Function Methods for the Description of Excited States: Excited State Proton Transfer Reactions as a Test Case
Juan Sanz García, Federica Maschietto, Marco Campetella, et al.
The Journal of Chemical Physics
|
June 5, 2023
MDiGest: A Python package for describing allostery from molecular dynamics simulations
Federica Maschietto, Brandon Allen, Gregory W Kyro, et al.
The Journal of Chemical Physics
|
July 9, 2021
Chasing unphysical TD-DFT excited states in transition metal complexes with a simple diagnostic tool
Federica Maschietto, Marco Campetella, Juan Sanz García, et al.
Journal of Molecular Biology
|
March 27, 2022
MptpA Kinetics Enhanced by Allosteric Control of an Active Conformation
Federica Maschietto, Erik Zavala, Brandon Allen, et al.
Biophysical Journal
|
December 5, 2021
Distinct allosteric pathways in imidazole glycerol phosphate synthase from yeast and bacteria
Federica Maschietto, Aria Gheeraert, Andrea Piazzi, et al.
PNAS Nexus
|
May 1, 2024
Kernel-elastic autoencoder for molecular design
Haote Li, Yu Shee, Brandon Allen, et al.
Journal of Computational Chemistry
|
August 2, 2017
Charge transfer excitations in TDDFT: A ghost-hunter index
Marco Campetella, Federica Maschietto, Mike J Frisch, et al.
Journal of Computational Chemistry
|
January 12, 2018
How are the charge transfer descriptors affected by the quality of the underpinning electronic density?
Federica Maschietto, Marco Campetella, Michael J Frisch, et al.
Nature Communications
|
June 28, 2020
Rationally designed ruthenium complexes for 1- and 2-photon photodynamic therapy
Johannes Karges, Shi Kuang, Federica Maschietto, et al.
Page
of 3