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Physical Chemistry Chemical Physics : PCCP
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October 11, 2021
Regression and clustering algorithms for AgCu nanoalloys: from mixing energy predictions to structure recognition
Cesare Roncaglia, Daniele Rapetti, Riccardo Ferrando
The Journal of Physical Chemistry. B
|
February 24, 2026
Making PLUMED Fly: A Tutorial on Optimizing Performance
Daniele Rapetti, Massimiliano Bonomi, Carlo Camilloni, et al.
The Journal of Chemical Physics
|
June 1, 2023
TimeSOAP: Tracking high-dimensional fluctuations in complex molecular systems via time variations of SOAP spectra
Cristina Caruso, Annalisa Cardellini, Martina Crippa, et al.
The Journal of Chemical Physics
|
February 24, 2026
dynsight: An open Python platform for simulation and experimental trajectory data analysis
Simone Martino, Matteo Becchi, Andrew Tarzia, et al.
Communications Chemistry
|
July 5, 2023
Machine learning of atomic dynamics and statistical surface identities in gold nanoparticles
Daniele Rapetti, Massimo Delle Piane, Matteo Cioni, et al.
The Journal of Chemical Physics
|
April 1, 2023
Innate dynamics and identity crisis of a metal surface unveiled by machine learning of atomic environments
Matteo Cioni, Daniela Polino, Daniele Rapetti, et al.
Advanced Science (Weinheim, Baden-Wurttemberg, Germany)
|
April 24, 2024
Sampling Real-Time Atomic Dynamics in Metal Nanoparticles by Combining Experiments, Simulations, and Machine Learning
Matteo Cioni, Massimo Delle Piane, Daniela Polino, et al.
The Journal of Chemical Physics
|
March 4, 2025
PLUMED Tutorials: A collaborative, community-driven learning ecosystem
Gareth A Tribello, Massimiliano Bonomi, Giovanni Bussi, et al.
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Search research articles
Search
Showing results (1-10 of 8) with videos related to
Sort By:
Page
of 1
Physical Chemistry Chemical Physics : PCCP
|
October 11, 2021
Regression and clustering algorithms for AgCu nanoalloys: from mixing energy predictions to structure recognition
Cesare Roncaglia, Daniele Rapetti, Riccardo Ferrando
The Journal of Physical Chemistry. B
|
February 24, 2026
Making PLUMED Fly: A Tutorial on Optimizing Performance
Daniele Rapetti, Massimiliano Bonomi, Carlo Camilloni, et al.
The Journal of Chemical Physics
|
June 1, 2023
TimeSOAP: Tracking high-dimensional fluctuations in complex molecular systems via time variations of SOAP spectra
Cristina Caruso, Annalisa Cardellini, Martina Crippa, et al.
The Journal of Chemical Physics
|
February 24, 2026
dynsight: An open Python platform for simulation and experimental trajectory data analysis
Simone Martino, Matteo Becchi, Andrew Tarzia, et al.
Communications Chemistry
|
July 5, 2023
Machine learning of atomic dynamics and statistical surface identities in gold nanoparticles
Daniele Rapetti, Massimo Delle Piane, Matteo Cioni, et al.
The Journal of Chemical Physics
|
April 1, 2023
Innate dynamics and identity crisis of a metal surface unveiled by machine learning of atomic environments
Matteo Cioni, Daniela Polino, Daniele Rapetti, et al.
Advanced Science (Weinheim, Baden-Wurttemberg, Germany)
|
April 24, 2024
Sampling Real-Time Atomic Dynamics in Metal Nanoparticles by Combining Experiments, Simulations, and Machine Learning
Matteo Cioni, Massimo Delle Piane, Daniela Polino, et al.
The Journal of Chemical Physics
|
March 4, 2025
PLUMED Tutorials: A collaborative, community-driven learning ecosystem
Gareth A Tribello, Massimiliano Bonomi, Giovanni Bussi, et al.
Page
of 1