Leonardo Guidoni
Title
Cited by
Cited by
Year
Reaction pathways for oxygen evolution promoted by cobalt catalyst
G Mattioli, P Giannozzi, A Amore Bonapasta, L Guidoni
Journal of the American Chemical Society 135 (41), 15353-15363, 2013
1792013
Potassium and Sodium Binding to the Outer Mouth of the K+ Channel
L Guidoni, V Torre, P Carloni
Biochemistry 38 (27), 8599-8604, 1999
1741999
Early steps of the intramolecular signal transduction in rhodopsin explored by molecular dynamics simulations
UF R÷hrig, L Guidoni, U Rothlisberger
Biochemistry 41 (35), 10799-10809, 2002
1372002
Water and potassium dynamics inside the KcsA K+ channel
L Guidoni, V Torre, P Carloni
FEBS letters 477 (1-2), 37-42, 2000
1272000
The S2 State of the Oxygen‐Evolving Complex of Photosystem II Explored by QM/MM Dynamics: Spin Surfaces and Metastable States Suggest a Reaction Path Towards theá…
D Bovi, D Narzi, L Guidoni
Angewandte Chemie International Edition 52 (45), 11744-11749, 2013
1242013
A molecular spring for vision
UF R÷hrig, L Guidoni, A Laio, I Frank, U Rothlisberger
Journal of the American Chemical Society 126 (47), 15328-15329, 2004
1142004
Polarization effects and charge transfer in the KcsA potassium channel
D Bucher, S Raugei, L Guidoni, M Dal Peraro, U Rothlisberger, P Carloni, ...
Biophysical chemistry 124 (3), 292-301, 2006
912006
Bathochromic shift in green fluorescent protein: a puzzle for QM/MM approaches
C Filippi, F Buda, L Guidoni, A Sinicropi
Journal of chemical theory and computation 8 (1), 112-124, 2012
852012
Potassium permeation through the KcsA channel: a density functional study
L Guidoni, P Carloni
Biochimica et Biophysica Acta (BBA)-Biomembranes 1563 (1-2), 1-6, 2002
842002
Pathway for Mn-cluster oxidation by tyrosine-Z in the S2 state of photosystem II
D Narzi, D Bovi, L Guidoni
Proceedings of the National Academy of Sciences 111 (24), 8723-8728, 2014
822014
Solvent and protein effects on the structure and dynamics of the rhodopsin chromophore
UF R÷hrig, L Guidoni, U Rothlisberger
ChemPhysChem 6 (9), 1836-1847, 2005
752005
Hybrid QM/MM Car-Parrinello simulations of catalytic and enzymatic reactions
MC Colombo, L Guidoni, A Laio, A Magistrato, P Maurer, S Piana, ...
CHIMIA International Journal for Chemistry 56 (1-2), 13-19, 2002
742002
Coordination numbers of K+ and Na+ ions inside the selectivity filter of the KcsA potassium channel: Insights from first principles molecular dynamics
D Bucher, L Guidoni, P Carloni, U Rothlisberger
Biophysical journal 98 (10), L47-L49, 2010
702010
Hydration properties of the bromide aqua ion: the interplay of first principle and classical molecular dynamics, and X-ray absorption spectroscopy
P D’Angelo, V Migliorati, L Guidoni
Inorganic chemistry 49 (9), 4224-4231, 2010
702010
Ab initio molecular dynamics simulation of liquid water by quantum Monte Carlo
A Zen, Y Luo, G Mazzola, L Guidoni, S Sorella
The Journal of chemical physics 142 (14), 144111, 2015
612015
Mechanism of Water Delivery to the Active Site of Photosystem II along the S2 to S3 Transition
M Capone, D Narzi, D Bovi, L Guidoni
The journal of physical chemistry letters 7 (3), 592-596, 2016
572016
Spin-liquid ground state in a two-dimensional nonfrustrated spin model
G Santoro, S Sorella, L Guidoni, A Parola, E Tosatti
Physical review letters 83 (15), 3065, 1999
551999
Reorganization of Substrate Waters between the Closed and Open Cubane Conformers during the S2 to S3 Transition in the Oxygen Evolving Complex
M Capone, D Bovi, D Narzi, L Guidoni
Biochemistry 54 (42), 6439-6442, 2015
492015
Static and dynamical correlation in diradical molecules by quantum Monte Carlo using the Jastrow antisymmetrized geminal power ansatz
A Zen, E Coccia, Y Luo, S Sorella, L Guidoni
Journal of Chemical Theory and Computation 10 (3), 1048-1061, 2014
492014
Dissecting the hydrogen bond: a quantum monte carlo approach
F Sterpone, L Spanu, L Ferraro, S Sorella, L Guidoni
Journal of chemical theory and computation 4 (9), 1428-1434, 2008
482008
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Articles 1–20