Riccardo Capelli
Riccardo Capelli
Department of Applied Science and Technology (DISAT), Politecnico di Torino
Email verificata su polito.it
Citata da
Citata da
Promoting transparency and reproducibility in enhanced molecular simulations
M Bonomi
Nature methods 16 (8), 670-673, 2019
Cooperative supramolecular block copolymerization for the synthesis of functional axial organic heterostructures
A Sarkar, T Behera, R Sasmal, R Capelli, C Empereur-Mot, J Mahato, ...
Journal of the American Chemical Society 142 (26), 11528-11539, 2020
Exhaustive search of ligand binding pathways via volume-based metadynamics
R Capelli, P Carloni, M Parrinello
The journal of physical chemistry letters 10 (12), 3495-3499, 2019
Chasing the full free energy landscape of neuroreceptor/ligand unbinding by metadynamics simulations
R Capelli, A Bochicchio, GM Piccini, R Casasnovas, P Carloni, ...
Journal of chemical theory and computation 15 (5), 3354-3361, 2019
Enhancing antibody serodiagnosis using a controlled peptide coimmobilization strategy
L Sola, P Gagni, I D’Annessa, R Capelli, C Bertino, A Romanato, F Damin, ...
ACS infectious diseases 4 (6), 998-1006, 2018
Accuracy of Molecular Simulation-Based Predictions of koff Values: A Metadynamics Study
R Capelli, W Lyu, V Bolnykh, S Meloni, JMH Olsen, U Rothlisberger, ...
The journal of physical chemistry letters 11 (15), 6373-6381, 2020
The subtle trade-off between evolutionary and energetic constraints in protein–protein interactions
F Marchetti, R Capelli, F Rizzato, A Laio, G Colombo
The journal of physical chemistry letters 10 (7), 1489-1497, 2019
MonteGrappa: An iterative Monte Carlo program to optimize biomolecular potentials in simplified models
G Tiana, F Villa, Y Zhan, R Capelli, C Paissoni, P Sormanni, E Heard, ...
Computer Physics Communications 186, 93-104, 2015
Assessment of mutational effects on peptide stability through confinement simulations
R Capelli, F Villemot, E Moroni, G Tiana, A van der Vaart, G Colombo
The journal of physical chemistry letters 7 (1), 126-130, 2016
An implementation of the maximum-caliber principle by replica-averaged time-resolved restrained simulations
R Capelli, G Tiana, C Camilloni
The Journal of chemical physics 148 (18), 184114, 2018
SAGE: a fast computational tool for linear epitope grafting onto a foreign protein scaffold
R Capelli, F Marchetti, G Tiana, G Colombo
Journal of chemical information and modeling 57 (1), 6-10, 2017
Swarm-CG: Automatic Parametrization of Bonded Terms in MARTINI-Based Coarse-Grained Models of Simple to Complex Molecules via Fuzzy Self-Tuning …
C Empereur-Mot, L Pesce, G Doni, D Bochicchio, R Capelli, C Perego, ...
ACS omega 5 (50), 32823-32843, 2020
BPSL1626: reverse and structural vaccinology reveal a novel candidate for vaccine design against Burkholderia pseudomallei
R Capelli, C Peri, R Villa, A Nithichanon, O Conchillo-Solé, D Yero, ...
Antibodies 7 (3), 26, 2018
Exact value for the average optimal cost of the bipartite traveling salesman and two-factor problems in two dimensions
R Capelli, S Caracciolo, A Di Gioacchino, EM Malatesta
Physical Review E 98 (3), 030101, 2018
Balancing accuracy and cost of confinement simulations by interpolation and extrapolation of confinement energies
F Villemot, R Capelli, G Colombo, A van der Vaart
Journal of chemical theory and computation 12 (6), 2779-2789, 2016
Designing Probes for Immunodiagnostics: Structural Insights into an Epitope Targeting Burkholderia Infections
R Capelli, E Matterazzo, M Amabili, C Peri, A Gori, P Gagni, M Chiari, ...
ACS infectious diseases 3 (10), 736-743, 2017
Iterative derivation of effective potentials to sample the conformational space of proteins at atomistic scale
R Capelli, C Paissoni, P Sormanni, G Tiana
The Journal of chemical physics 140 (19), 05B615_1, 2014
A data-driven dimensionality reduction approach to compare and classify lipid force fields
R Capelli, A Gardin, C Empereur-Mot, G Doni, GM Pavan
The Journal of Physical Chemistry B 125 (28), 7785-7796, 2021
Coevolutionary data-based interaction networks approach highlighting key residues across protein families: The case of the G-protein coupled receptors
F Baldessari, R Capelli, P Carloni, A Giorgetti
Computational and structural biotechnology journal 18, 1153-1159, 2020
Multiscale Molecular Modelling of ATP-fueled Supramolecular Polymerisation and Depolymerisation
C Perego, L Pesce, R Capelli, SJ George, GM Pavan
ChemRxiv, 2020
Il sistema al momento non può eseguire l'operazione. Riprova più tardi.
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