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Daniele Loco

Years Active: 2017-2021
Publications (10 Years): 6

Université Paris-Sorbonne

University of Pisa (PHD)

This page only lists publications with an associated author ORCID identifier.

Affiliation History

Université Paris-Sorbonne Mar 1o 2018

France

Post-doc :: Laboratoire de Chimie Theorique

Education History

University of Pisa Nov 1o 2014 - Jan 8o 2018

Italy

PHD :: Department of Chemistry and Industrial Chemistry

Publications

Daniele Loco, Louis Lagardère, Olivier Adjoua, Jean-Philip Piquemal
Atomistic Polarizable Embeddings: Energy, Dynamics, Spectroscopy, and Reactivity. Accounts of chemical research 54 (13) (2021)
Daniele Loco, Riccardo Spezia, François Cartier, Isabelle Chataigner, Jean-Philip Piquemal
Solvation effects drive the selectivity in Diels-Alder reaction under hyperbaric conditions. Chemical communications (Cambridge, England) 56 (49) (2020)
Daniele Loco, Louis Lagardère, Gerardo Andrés Cisneros, Giovanni Scalmani, Michael Frisch, Filippo Lipparini, Benedetta Mennucci, Jean-Philip Piquemal
Towards large scale hybrid QM/MM dynamics of complex systems with advanced point dipole polarizable embeddings. Chemical science 10 (30) (2019)
Daniele Loco, Francesco Buda, Johan Lugtenburg, Benedetta Mennucci
The Dynamic Origin of Color Tuning in Proteins Revealed by a Carotenoid Pigment. The journal of physical chemistry letters 9 (9) (2018)
Daniele Loco, Louis Lagardère, Stefano Caprasecca, Filippo Lipparini, Benedetta Mennucci, Jean-Philip Piquemal
Hybrid QM/MM Molecular Dynamics with AMOEBA Polarizable Embedding. Journal of chemical theory and computation 13 (9) (2017)
Daniele Loco, Natalia Gelfand, Sandro Jurinovich, Stefano Protti, Alberto Mezzetti, Benedetta Mennucci
Polarizable QM/Classical Approaches for the Modeling of Solvation Effects on UV-Vis and Fluorescence Spectra: An Integrated Strategy. The journal of physical chemistry. A 122 (1) (2017)

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