Sfoglia per Autore
Proxy dynamic delegation in grid gateway
2011 Calzolari, Federico; Licari, Daniele
The Anatomy of a Grid portal
2011 Licari, Daniele; Calzolari, Federico
Computational tools for the interpretation of electron spin resonance spectra in solution
2013 Mirco, Zerbetto; Licari, Daniele; Barone, Vincenzo; Antonino, Polimeno
Joyce and Ulysses: integrated and user-friendly tools for the parameterization of intramolecular force fields from quantum mechanical data
2013 Barone, Vincenzo; Ivo, Cacelli; DE MITRI, Nicola; Licari, Daniele; Susanna, Monti; Giacomo, Prampolini
Graphical Interfaces and Virtual Reality for Molecular Sciences
2014 Salvadori, A.; Licari, D.; Mancini, G.; Brogni, A.; De Mitri, N.; Barone, V.
Environmental and complexation effects on the structures and spectroscopic signatures of organic pigments relevant to cultural heritage: the case of alizarin and alizarin–Mg(ii)/Al(iii) complexes
2014 Luciano, Carta; Malgorzata, Biczysko; Bloino, JULIEN ROLAND MICHEL; Licari, Daniele; Barone, Vincenzo
Implementation of a graphical user interface for the virtual multifrequency spectrometer: The VMS-Draw tool
2015 Licari, Daniele; Baiardi, Alberto; Biczysko, MALGORZATA AGNIESZKA; Egidi, Franco; Latouche, Camille; Barone, Vincenzo
The Smart Cyberinfrastructure: Space-Time Multiscale Approaches for Research and Technology
2016 Licari, Daniele; Mancini, Giordano; Brogni, Andrea; Salvadori, Andrea; Barone, Vincenzo
Development and Implementation of Advanced Fitting Methods for the Calculation of Accurate Molecular Structures
2017 Mendolicchio, Marco; Penocchio, Emanuele; Licari, Daniele; Tasinato, Nicola; Barone, Vincenzo
A Modular Implementation for the Simulation of 1D and 2D Solid-State NMR Spectra of Quadrupolar Nuclei in the Virtual Multifrequency Spectrometer-Draw Graphical Interface
2017 Presti, Davide; Pedone, Alfonso; Licari, Daniele; Barone, Vincenzo
Towards the SMART workflow system for computational spectroscopy
2018 Licari, D.; Fusè, M.; Salvadori, A.; Tasinato, N.; Mendolicchio, M.; Mancini, G.; Barone, V.
Machine Learning of Potential-Energy Surfaces Within a Bond-Order Sampling Scheme
2019 Licari, D.; Rampino, S.; Barone, V.
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