Daniele Loco
0000-0002-6808-7515
Université Paris-Sorbonne
6 papers found
Refreshing results…
Solvation effects drive the selectivity in Diels-Alder reaction under hyperbaric conditions
Towards large scale hybrid QM/MM dynamics of complex systems with advanced point dipole polarizable embeddings
Modeling the absorption lineshape of embedded systems from molecular dynamics: A tutorial review
The Dynamic Origin of Color Tuning in Proteins Revealed by a Carotenoid Pigment
Polarizable QM/Classical Approaches for the Modeling of Solvation Effects on UV–Vis and Fluorescence Spectra: An Integrated Strategy
Hybrid QM/MM Molecular Dynamics with AMOEBA Polarizable Embedding
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