引用次数
引用: 4,284
H-指数: 38
I10-指数 : 85
出版物: 165
Structural and dynamic insights into Mn 4 Ca cluster-depleted Photosystem II
Daniele Narzi , Leonardo Guidoni
Physical Chemistry Chemical Physics 23 ( 48) 27428 -27436
4
2021
Natural orbitals and sparsity of quantum mutual information
Leonardo Ratini , Chiara Capecci , Leonardo Guidoni
Journal of Chemical Theory and Computation 20 ( 9) 3535 -3542
2
2024
Optimization strategies in WAHTOR algorithm for quantum computing empirical ansatz: a comparative study
Leonardo Ratini , Chiara Capecci , Leonardo Guidoni
Electronic Structure 5 ( 4) 045006 -045006
1
2023
Mechanism of Oxygen Evolution and Mn₄CaO₅ Cluster Restoration in the Natural Water-Oxidizing Catalyst
Matteo Capone , Daniele Narzi , Leonardo Guidoni
2021
Pathway for Mn-cluster oxidation by tyrosine-Z in the S₂ state of photosystem II
Daniele Narzi , Daniele Bovi , Leonardo Guidoni
2014
Chemical and protein shifts in the spectrum of the photoactive yellow protein: a time-dependent density functional theory/molecular mechanics study (vol 11, pg 4556, 2009)
Eneritz Muguruza Gonzalez , Leonardo Guidoni , Carla Molteni
PHYSICAL CHEMISTRY CHEMICAL PHYSICS 11 ( 48) 11659 -11659
2009
FIRST PRINCIPLES QUANTUM MECHANICS/MOLECULAR MECHANICS (QM/MM) SIMULATIONS OF BIOLOGICAL SYSTEMS
Leonardo Guidoni
Acta Biophysica Romana 126 1 -1
2006
Molecular dynamics study of a potassium channel.
Leonardo Guidoni
SISSA
1998
IRMPD Spectroscopy and Quantum Chemistry Calculations on Metal-Ligand Cluster Ions
Nicolas Nieuwjaer , Ali Beydoun , Frédéric Lecomte , Bruno Manil
Multiscale molecular modeling of photosynthetic water oxidation mechanism
Matteo Capone , Davide Gabrielli , Leonardo Guidoni
Supporting Information:“Geometry optimization of Multicenter Transition Metal clusters through Extended Broken Symmetry approach”
Shibing Chu , Daniele Bovi , Francesco Cappelluti , Alberto Giacomo Orellana
Quantum Monte Carlo meets Quantum Chemistry: new approaches for electron correlation
Leonardo Guidoni
An algorithm to calculate the ground state (low-spin) energy and force of multi-centre transition metal (MCTM) complexes
Henry Martin , Daniele Bovi , Leonardo Guidoni
AB INITIO MOLECULAR DYNAMICS IN NATURAL AND ARTIFICIAL PHOTOSYNTHESIS
Leonardo Guidoni , Daniele Bovi , Daniele Narzi , Giuseppe Mattioli
Effect of The Protein Electric Field on The Spectral Tuning Of A Photosynthetic System
Leonardo Guidoni , Daniele Narzi , Ganesh Sivaraman
Hydride Fluxionality in Transition Metal Complexes: Mechanistic Insights from Density Functional Theory Calculations and Orbital Biased Molecular Dynamics Simulations
Nicolas Sieffert , Carole A Morrison , Leonardo Guidoni
The TEA plus extracellular binding site of the KcsA potassium channel: Implications for the ion-blocker interactions
L Guidoni , P Carloni
BIOPHYSICAL JOURNAL 82 ( 1) 351A -351A
2002
Barrier crossing in the selectivity filter of KcsA potassium channel
L Guidoni , V Torre , P Carloni
BIOPHYSICAL JOURNAL 80 ( 1) 175A -175A
2001
Hydration and dynamics of the K+ channel
L Guidoni , V Torre , P Carloni
BIOPHYSICAL JOURNAL 78 ( 1) 138A -138A
2000
Mechanism of barrier crossing in the potassium channel
L Guidoni , A Lalo , V Torre , P Carloni
BIOPHYSICAL JOURNAL 78 ( 1) 18A -18A
2000