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Laio, Alessandro
 Distribuzione geografica
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Continente #
EU - Europa 12.910
NA - Nord America 10.153
AS - Asia 5.907
SA - Sud America 846
AF - Africa 104
Continente sconosciuto - Info sul continente non disponibili 26
OC - Oceania 21
Totale 29.967
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Nazione #
US - Stati Uniti d'America 9.784
RU - Federazione Russa 5.979
CN - Cina 2.092
IT - Italia 2.053
SG - Singapore 1.865
SE - Svezia 1.137
IE - Irlanda 937
BR - Brasile 767
UA - Ucraina 654
DE - Germania 557
HK - Hong Kong 544
TR - Turchia 518
GB - Regno Unito 471
KR - Corea 339
CA - Canada 293
FI - Finlandia 289
FR - Francia 182
VN - Vietnam 144
NL - Olanda 125
CH - Svizzera 121
PL - Polonia 87
IN - India 81
JP - Giappone 79
BE - Belgio 66
ES - Italia 60
MX - Messico 56
AT - Austria 44
ZA - Sudafrica 39
BD - Bangladesh 31
CZ - Repubblica Ceca 31
LB - Libano 31
EU - Europa 26
AR - Argentina 25
UZ - Uzbekistan 25
GR - Grecia 24
IQ - Iraq 23
LT - Lituania 17
PK - Pakistan 17
MA - Marocco 16
AU - Australia 14
EC - Ecuador 14
TW - Taiwan 14
BG - Bulgaria 12
RO - Romania 11
SA - Arabia Saudita 11
KE - Kenya 10
MY - Malesia 10
DK - Danimarca 9
PH - Filippine 9
CO - Colombia 8
ID - Indonesia 8
JO - Giordania 8
PY - Paraguay 8
SI - Slovenia 8
SK - Slovacchia (Repubblica Slovacca) 8
VE - Venezuela 8
IL - Israele 7
AE - Emirati Arabi Uniti 6
DZ - Algeria 6
IR - Iran 6
NP - Nepal 6
NZ - Nuova Zelanda 6
PA - Panama 6
TN - Tunisia 6
EG - Egitto 5
PE - Perù 5
UY - Uruguay 5
JM - Giamaica 4
KZ - Kazakistan 4
LK - Sri Lanka 4
NO - Norvegia 4
PT - Portogallo 4
RS - Serbia 4
BA - Bosnia-Erzegovina 3
BO - Bolivia 3
DO - Repubblica Dominicana 3
GH - Ghana 3
HU - Ungheria 3
MD - Moldavia 3
TH - Thailandia 3
TZ - Tanzania 3
AL - Albania 2
AM - Armenia 2
AZ - Azerbaigian 2
CL - Cile 2
CY - Cipro 2
ET - Etiopia 2
GA - Gabon 2
GE - Georgia 2
LA - Repubblica Popolare Democratica del Laos 2
LU - Lussemburgo 2
NI - Nicaragua 2
OM - Oman 2
PS - Palestinian Territory 2
TM - Turkmenistan 2
AF - Afghanistan, Repubblica islamica di 1
BH - Bahrain 1
BJ - Benin 1
BW - Botswana 1
BY - Bielorussia 1
Totale 29.944
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Città #
Moscow 1.689
Dallas 1.434
Chandler 1.108
Dublin 936
Singapore 828
Jacksonville 795
Ashburn 662
Scuola 565
Ann Arbor 544
Hong Kong 518
New York 488
Boardman 409
Wilmington 358
Beijing 349
Hefei 333
Trieste 317
Saint Petersburg 291
Woodbridge 289
Izmir 275
Nanjing 263
Istanbul 219
Toronto 211
The Dalles 187
Seoul 172
Los Angeles 163
Munich 162
Santa Clara 153
Columbus 150
Princeton 149
Helsinki 148
Pisa 144
Shanghai 138
Council Bluffs 121
Milan 121
Houston 112
Ogden 106
Nanchang 102
Buffalo 95
Brooklyn 93
São Paulo 84
Rome 66
Brussels 65
Warsaw 55
Dearborn 52
Dong Ket 49
London 45
Tokyo 44
Chicago 43
Kunming 42
Changsha 39
Denver 37
Falls Church 37
Jiaxing 36
Montreal 34
Seattle 34
Shenyang 34
Bremen 33
Candelo 33
Orem 33
Stockholm 33
Hebei 32
Ho Chi Minh City 30
Tianjin 30
Amsterdam 29
Guangzhou 29
Verona 29
Hanoi 28
Lausanne 28
Redondo Beach 28
Redwood City 28
Atlanta 27
Belo Horizonte 27
Phoenix 27
Johannesburg 25
Zhengzhou 25
Boston 24
Mexico City 24
Poplar 24
Vienna 24
Washington 24
Orange 23
Chennai 22
San Francisco 22
Turin 22
Hangzhou 21
Rio de Janeiro 20
Las Vegas 18
Paris 18
Ankara 17
Den Haag 17
Naples 17
Porto Alegre 17
Turku 16
Manchester 15
Redmond 15
Bologna 14
Des Moines 14
Padova 14
San Jose 14
Udine 14
Totale 17.017
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Nome #
Using metadynamics to explore complex free-energy landscapes 474
Clustering by fast search-and-find of density peaks 391
Promoting transparency and reproducibility in enhanced molecular simulations 373
Metadynamics: A Unified Framework for Accelerating Rare Events and Sampling Thermodynamics and Kinetics 351
Simulation of Iron at Earth's Core Conditions 329
Estimating the intrinsic dimension of datasets by a minimal neighborhood information 326
A structural, functional, and computational analysis suggests pore flexibility as the base for the poor selectivity of CNG channels 321
Unfolding and identification of membrane proteins in situ 310
Automatic feature selection and weighting in molecular systems using Differentiable Information Imbalance 303
Towards a robust approach to infer causality from molecular dynamics simulations 301
Robust inference of causality in high-dimensional dynamical processes from the Information Imbalance of distance ranks 295
A Markov state modeling analysis of sliding dynamics of a 2D model 294
In Silico Design of Short Peptides as Sensing Elements for Phenolic Compounds 287
Intrinsic dimension of data representations in deep neural networks 285
Computational design of cyclic peptides for the customized oriented immobilization of globular proteins 281
Peptide biosensors for anticancer drugs: Design in silico to work in denaturizing environment 266
Permeability Coefficients of Lipophilic Compounds Estimated by Computer Simulations 264
Computing the Free Energy without Collective Variables 257
Protein-protein structure prediction by scoring molecular dynamics trajectories of putative poses 248
A candidate ion-retaining state in the inward-facing conformation of sodium/galactose symporter: Clues from atomistic simulations 248
New views on phototransduction from atomic force microscopy and single molecule force spectroscopy on native rods 247
Absolute Transition Rates for Rare Events from Dynamical Decoupling of Reaction Variables 245
A Novel Approach to the Investigation of Passive Molecular Permeation through Lipid Bilayers from Atomistic Simulations 242
Sampling Molecular Conformers in Solution with Quantum Mechanical Accuracy at a Nearly Molecular-Mechanics Cost 242
A fingerprint of surface-tension anisotropy in the free-energy cost of nucleation 240
Native fold and docking pose discrimination by the same residue-based scoring function 239
Calculating thermodynamics properties of quantum systems by a non-Markovian Monte Carlo procedure 238
The inverted free energy landscape of an intrinsically disordered peptide by simulations and experiments 236
Binding affinity prediction of nanobody-protein complexes by scoring of molecular dynamics trajectories 234
Sodium-Galactose Transporter: first steps of transport mechanism investigated by molecular dynamics 234
Sodium-Galactose Transporter: The First Steps of the Transport Mechanism Investigated by Molecular Dynamics 233
The permeation mechanism of organic cations through a CNG mimic channel 233
Linear Scaling Causal Discovery from High-Dimensional Time Series by Dynamical Community Detection 232
Designing High-Affinity Peptides for Organic Molecules by Explicit Solvent Molecular Dynamics 232
A simple and efficient statistical potential for scoring ensembles of protein structures 230
Toward a unified scoring function for native state discrimination and drug-binding pocket recognition 227
A Hamiltonian electrostatic coupling scheme for hybrid Car-Parrinello molecular dynamics simulations 226
Amyloid beta Protein and Alzheimer's Disease: When Computer Simulations Complement Experimental Studies 226
Atomistic structure of cobalt-phosphate nanoparticles for catalytic water oxidation 226
"Site binding" of Ca2+ ions to polyacrylates in water: A molecular dynamics study of coiling and aggregation 226
Force generation in lamellipodia is a probabilistic process with fast growth and retraction events 224
Assessing the capability of in silico mutation protocols for predicting the finite temperature conformation of amino acids 219
A QUICKSTEP-based quantum mechanics molecular mechanics approach for silica 215
Metadynamics: a method to simulate rare events and reconstruct the free energy in biophysics, chemistry and material science 215
QMMMW: A wrapper for QM/MM simulations with QUANTUM ESPRESSO and LAMMPS 214
fMRI single trial discovery of spatio-temporal brain activity patterns 213
The intrinsic dimension of protein sequence evolution 213
Are structural biases at protein termini a signature of vectorial folding? 212
Computational Design of Peptides Bound to the Major Histocompatibility Complex Class II 212
Predicting amino acid substitution probabilities using single nucleotide polymorphisms 210
Markov state modeling of sliding friction 210
A comparative theoretical study of dipeptide solvation in water 209
A minimum free energy reaction path for the E2 reaction between fluoro ethane and a fluoride ion 207
A recipe for the computation of the free energy barrier and the lowest free energy path of concerted reactions 202
A Kinetic Model of Trp-Cage Folding from Multiple Biased Molecular Dynamics Simulations 201
A common root for coevolution and substitution rate variability in protein sequence evolution 200
A Collective Variable for the Efficient Exploration of Protein Beta-Sheet Structures: Application to SH3 and GB1 200
A bias-exchange approach to protein folding 198
Automatic topography of high-dimensional data sets by non-parametric density peak clustering 195
Prune and distill: similar reformatting of image information along rat visual cortex and deep neural networks 194
Vacancy-vacancy interaction and oxygen diffusion in stabilized cubic ZrO2 from first principles 193
Predicting crystal structures: The Parrinello-Rahman method revisited 189
Explicit Characterization of the Free-Energy Landscape of a Protein in the Space of All Its Cα Carbons 187
Representation mitosis in wide neural networks 186
Description and Characterization of a Highly Stable Enthalpic Intermediate State in Mouse Prion Protein Folding 185
Non-Markovian effects on protein sequence evolution due to site dependent substitution rates 185
A molecular spring for vision 184
Characterization of the dizinc analogue of the synthetic diiron protein DF1 using ab initio and hybrid quantum/classical molecular dynamics simulations 184
DADApy: Distance-based analysis of data-manifolds in Python 183
BACHSCORE. A tool for evaluating efficiently and reliably the quality of large sets of protein structures 181
The Subtle Trade-Off between Evolutionary and Energetic Constraints in Protein-Protein Interactions 180
A Monte Carlo approach to the conformal bootstrap 179
Flexible docking in solution using metadynamics 178
Protein folding with combined parallel tempering and metadynamics 176
METAGUI 3: A graphical user interface for choosing the collective variables in molecular dynamics simulations 176
A Rosetta-based protein design protocol converging to natural sequences 175
Metadynamics surfing on topology barriers: the CP N−1 case 173
QM/MM Car-Parrinello molecular dynamics study of the solvent effects on the ground state and on the first excited singlet state of acetone in water 173
Systematic improvement of classical nucleation theory 171
Role of Enzyme Flexibility in Ligand Access and Egress to Active Site: Bias-Exchange Metadynamics Study of 1,3,7-Trimethyluric Acid in Cytochrome P450 3A4 170
Candidate Binding Sites for Allosteric Inhibition of the SARS-CoV-2 Main Protease from the Analysis of Large-Scale Molecular Dynamics Simulations 169
Free-Energy Landscape for β Hairpin Folding from Combined Parallel Tempering and Metadynamics 168
Automatic classification of single-molecule force spectroscopy traces from heterogeneous samples 166
Fusing simulation and experiment: The effect of mutations on the structure and activity of the influenza fusion peptide 166
Vibrational entropy estimation can improve binding affinity prediction for non-obligatory protein complexes 166
D-RESP: Dynamically generated electrostatic potential derived charges from quantum mechanics/molecular mechanics simulations 165
Unsupervised Learning Methods for Molecular Simulation Data 165
PHYS 410-Beta-hairpin folding with parallel-tempering and metadynamics 163
Hybrid QM/MM Car-Parrinello simulations of catalytic and enzymatic reactions 163
Data segmentation based on the local intrinsic dimension 163
Interacting hard-core bosons and surface physics 162
Quantum theory of frequency shifts of an electromagnetic wave interacting with a plasma 162
Assessing the accuracy of metadynamics 161
A consensus protocol for the in silico optimisation of antibody fragments 161
Escaping free-energy minima 160
Ab initio simulations of Lewis-acid-catalyzed hydrosilylation of alkynes 158
Initial stages of salt crystal dissolution determined with ab initio molecular dynamics 157
Deciphering the folding kinetics of transmembrane helical proteins 156
Statistically unbiased free energy estimates from biased simulations 155
Azulene-to-naphthalene rearrangement: The Car-Parrinello metadynamics method explores various mechanisms 154
Totale 21.903
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Categoria #
all - tutte 125.344
article - articoli 0
book - libri 0
conference - conferenze 0
curatela - curatele 0
other - altro 0
patent - brevetti 0
selected - selezionate 0
volume - volumi 0
Totale 125.344
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Totale Lug Ago Sett Ott Nov Dic Gen Feb Mar Apr Mag Giu
2020/20211.198 0 0 0 0 0 336 173 22 196 199 65 207
2021/20221.529 231 174 17 148 207 54 96 167 88 56 114 177
2022/20233.923 543 393 319 339 240 768 398 290 380 64 76 113
2023/20242.206 150 61 82 52 309 687 63 111 363 112 103 113
2024/20257.682 972 387 721 1.462 806 318 502 477 330 258 655 794
2025/20268.282 443 1.493 1.028 1.172 1.641 2.505 0 0 0 0 0 0
Totale 30.655