Leonardo Guidoni
TitleCited byYear
Potassium and Sodium Binding to the Outer Mouth of the K+ Channel
L Guidoni, V Torre, P Carloni
Biochemistry 38 (27), 8599-8604, 1999
1731999
Early steps of the intramolecular signal transduction in rhodopsin explored by molecular dynamics simulations
UF Röhrig, L Guidoni, U Rothlisberger
Biochemistry 41 (35), 10799-10809, 2002
1372002
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
1362013
Water and potassium dynamics inside the KcsA K+ channel
L Guidoni, V Torre, P Carloni
FEBS letters 477 (1-2), 37-42, 2000
1252000
A molecular spring for vision
UF Röhrig, L Guidoni, A Laio, I Frank, U Rothlisberger
Journal of the American Chemical Society 126 (47), 15328-15329, 2004
1132004
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 the …
D Bovi, D Narzi, L Guidoni
Angewandte Chemie International Edition 52 (45), 11744-11749, 2013
972013
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
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
Solvent and protein effects on the structure and dynamics of the rhodopsin chromophore
UF Röhrig, L Guidoni, U Rothlisberger
ChemPhysChem 6 (9), 1836-1847, 2005
772005
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, 2011
712011
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
712002
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
652010
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
642014
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
582010
Green Oxidation Catalysts: Computational Design of High‐Efficiency Models of Galactose Oxidase
L Guidoni, K Spiegel, M Zumstein, U Röthlisberger
Angewandte Chemie 116 (25), 3348-3351, 2004
562004
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
561999
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
482015
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
462008
Phase separation in the two-dimensional Hubbard model: A fixed-node quantum Monte Carlo study
AC Cosentini, M Capone, L Guidoni, GB Bachelet
Physical Review B 58 (22), R14685, 1998
441998
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
432016
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Articles 1–20