GiovanniMaria Piccini

University of Modena and Reggio Emilia — Italy

Physics and Astronomy · Physical Sciences

26h-index3.4kcitations80works2.62yr avg
OpenAlex↗ORCID↗Google Scholar↗Lab page↗

Accepting Students?

No reports yet. Know if this professor is taking students?

Research Topics

Advanced Chemical Physics Studies(13), Spectroscopy and Quantum Chemical Studies(13), Protein Structure and Dynamics(11), Supramolecular Chemistry and Complexes(11), Machine Learning in Materials Science(11)

Publications80 total

Exploring chemistry and catalysis by biasing skewed distributions via deep learning
Nature Communications·2026Open Access
To Be or Not to Be: The Elusive Nature of Wheland-type Intermediates in Zeolite-Catalyzed Aromatic Alkylation Revealed by CCSD(T)-quality Metadynamics
2026Open Access
Exploring Chemistry and Catalysis by Biasing Skewed Distributions via Deep Learning
2025· 1 citedOpen Access
Designing Light‐Sensitive Organic Semiconductors with Azobenzenes for Photoelectrochemical Transistors as Neuromorphic Platforms
Advanced Science·2025Open Access
Molecular-Level Mechanistic Insights into PETase-Catalyzed Plastics Hydrolysis from Accurate QM/MM Free Energy Calculations
ACS Catalysis·2025· 6 citedOpen Access
Exploring Chemistry and Catalysis by Biasing Skewed Distributions via Deep Learning
2025Open Access
Exploring Chemistry and Catalysis by Biasing Skewed Distributions via Deep Learning
2025Open Access
Molecular-Level Mechanistic Insights into PETase-Catalyzed Plastics Hydrolysis from Accurate QM/MM Free Energy Calculations
2025Open Access
Tetrafluororesorcin[4]arene Hexameric Capsule Enables the Expansion of the Reactivity Space in Supramolecular Catalysis
Journal of the American Chemical Society·2025· 8 cited
Protonation Dynamics of Confined Ethanol–Water Mixtures in H-ZSM-5 from Machine Learning-Driven Metadynamics
SSRN Electronic Journal·2025Open Access
Designing Light‐Sensitive Organic Semiconductors with Azobenzenes for Photoelectrochemical Transistors as Neuromorphic Platforms
JuSER Publikationsportal·2025Open Access
Designing Light-Sensitive Organic Semiconductors with Azobenzenes for Photoelectrochemical Transistors as Neuromorphic Platforms
RWTH Publications (RWTH Aachen)·2025Open Access
Unusual Reaction of Isocyanides with Aromatic Aldehydes Catalyzed by a Supramolecular Capsule
Chemistry - A European Journal·2024Open Access
FESTA: A Polygon-Based Approach for Extracting Relevant Structures from Free Energy Surfaces Obtained in Molecular Simulations
Journal of Chemical Information and Modeling·2024· 1 citedOpen Access
Window[1]resorcin[3]arenes: A Novel Macrocycle Able to Self-Assemble to a Catalytically Active Hexameric Cage
JACS Au·2024· 6 citedOpen Access
Lithium-ion hopping weakens thermal stability of LiPF6 carbonate electrolytes
Cell Reports Physical Science·2024· 20 citedOpen Access
Atomistic Insights into Hydrogen-Bonded Supramolecular Capsule Self-Assembly Dynamics
The Journal of Physical Chemistry C·2023· 12 citedOpen Access
Physical Chemistry of Chloroquine Permeation through the Cell Membrane with Atomistic Detail
Journal of Chemical Information and Modeling·2023· 4 citedOpen Access
Atomistic Insights into Hydrogen-Bonded Supramolecular Capsule Self-Assembly Dynamics
2023· 2 citedOpen Access
Data supporting "Atomistic Insights into Hydrogen-Bonded Supramolecular Capsule Assembly Dynamics"
2023Open Access
page 1 of 4Next →

Frequent Co-authors

Michele Parrinello(19), Konrad Tiefenbacher(10), Joachim Sauer(8), Paolo Carloni(6), Riccardo Capelli(5), Dan Mendels(5), Maristella Alessio(5), Emanuele Grifoni(4), Roger Rousseau(4), Tian‐Ren Li(4), Johannes A. Lercher(3), Vassiliki‐Alexandra Glezakou(3), Melina Knezevic(3), Michael Heilmann(3), Mirko Paulikat(3), Emiliano Ippoliti(3), Giulia Rossetti(3), Fabio Arnesano(3), Ómar Valsson(2), Luigi Bonati(2)