| 2021 | ICCSA | Free-Methane - from the Ionosphere of Mars Towards a Prototype Methanation Reactor: A Project Producing Fuels via Plasma Assisted Carbon Dioxide Hydrogenation. | Stefano Falcinelli, Marzio Rosi, Marco Parriani, Antonio Lagan |
| 2019 | ICCSA | Cloud and Local Servers for a Federation of Molecular Science Learning Object Repositories. | Sergio Tasso, Simonetta Pallottelli, Osvaldo Gervasi, Federico Sabbatini, Valentina Franzoni, Antonio Lagan |
| 2018 | ICCSA | A Circular Economy Proposal on CO _2 Reuse to Produce Methane Using Energy from Renewable Sources. | Antonio Lagan, Lorenzo di Giorgio |
| 2018 | ICCSA | The ECTN Virtual Education Community Prosumer Model for Promoting and Assessing Chemical Knowledge. | Antonio Lagan, Osvaldo Gervasi, Sergio Tasso, Damiano Perri, Francesco Franciosa |
| 2018 | ICCSA | Sharing Learning Objects Between Learning Platforms and Repositories. | Sergio Tasso, Simonetta Pallottelli, Osvaldo Gervasi, Marina Rui, Antonio Lagan |
| 2017 | ICCSA | Open Molecular Science for the Open Science Cloud. | Antonio Lagan, Gbor Terstynszky, Jens Krger |
| 2017 | ICCSA | Automated Simulation of Gas-Phase Reactions on Distributed and Cloud Computing Infrastructures. | Sergio Rampino, Loriano Storchi, Antonio Lagan |
| 2016 | ICCSA | Simulation of Methane Production from Carbon Dioxide on a Collaborative Research Infrastructure. | Carles Mart, Leonardo Pacifici, Andrea Capriccioli, Antonio Lagan |
| 2016 | ICCSA | Modeling Combustions: The ab initio Treatment of the O( ^3 P) + CH _3 OH Reaction. | Leonardo Pacifici, Francesco Talotta, Nadia Balucani, Noelia Faginas Lago, Antonio Lagan |
| 2016 | ICCSA | Mobile Device Access to Collaborative Distributed Repositories of Chemistry Learning Objects. | Sergio Tasso, Simonetta Pallottelli, Antonio Lagan |
| 2015 | ICCSA | Ion-Water Cluster Molecular Dynamics Using a Semiempirical Intermolecular Potential. | Noelia Faginas Lago, Margarita Albert, Antonio Lagan, Andrea Lombardi |
| 2015 | ICCSA | A Trial User, Resources and Services Quality Evaluation for Grid Communities Sustainability. | Carlo Manuali, Antonio Lagan |
| 2015 | ICCSA | Exchange of Learning Objects Between a Learning Management System and a Federation of Science Distributed Repositories. | Simonetta Pallottelli, Sergio Tasso, Marina Rui, Antonio Lagan, Ioannis Kozaris |
| 2014 | ICCSA | On the Implementation of Three Popular Computational Chemistry Applications Using the EGI Distributed Computing Infrastructure. | Alessandro Costantini, Daniele Cesini, Diego Michelotto, Marco Bencivenni, Vania Boccia, Emidio Giorgio, Antonio Lagan |
| 2014 | ICCSA | A Grid Empowered Virtual Versus Real Experiment for the Barrierless Li + FH → LiF + H Reaction. | Antonio Lagan, Sergio Rampino |
| 2014 | ICCSA | The Molecular Stirrer Catalytic Effect in Methane Ice Formation. | Noelia Faginas Lago, Margarita Albert, Antonio Lagan, Andrea Lombardi, Leonardo Pacifici, Alessandro Costantini |
| 2014 | ICCSA | Grid Calculation Tools for Massive Applications of Collision Dynamics Simulations: Carbon Dioxide Energy Transfer. | Andrea Lombardi, Noelia Faginas Lago, Antonio Lagan |
| 2014 | ICCSA | Learning Objects Efficient Handling in a Federation of Science Distributed Repositories. | Sergio Tasso, Simonetta Pallottelli, Marina Rui, Antonio Lagan |
| 2013 | ICCSA | Implementation of the ANSYS Commercial Suite on the EGI Grid Platform. | Alessandro Costantini, Diego Michelotto, Marco Bencivenni, Daniele Cesini, Paolo Veronesi, Emidio Giorgio, Luciano Gaido, Antonio Lagan, Alberto Monetti, Mattia Manzolaro, Alberto Andrighetto |
| 2013 | ICCSA | Water (H2O) m or Benzene (C6H6) n Aggregates to Solvate the K + ? | Noelia Faginas Lago, Margarita Albert, Antonio Lagan, Andrea Lombardi |
| 2013 | ICCSA | Carbon Oxides in Gas Flows and Earth and Planetary Atmospheres: State-to-State Simulations of Energy Transfer and Dissociation Reactions. | Andrea Lombardi, Antonio Lagan, Fernando Pirani, Federico Palazzetti, Noelia Faginas Lago |
| 2013 | ICCSA | Multi Reference versus Coupled Cluster ab Initio Calculations for the N2 + N2 Reaction Channels. | Leonardo Pacifici, Marco Verdicchio, Antonio Lagan |
| 2013 | ICCSA | An Efficient Taxonomy Assistant for a Federation of Science Distributed Repositories: A Chemistry Use Case. | Sergio Tasso, Simonetta Pallottelli, Giovanni Ciavi, Riccardo Bastianini, Antonio Lagan |
| 2012 | ICCSA | A Grid Execution Model for Computational Chemistry Applications Using the GC3Pie Framework and the AppPot VM Environment. | Alessandro Costantini, Riccardo Murri, Sergio Maffioletti, Antonio Lagan |
| 2012 | ICCSA | The MPI Structure of Chimere. | Antonio Lagan, Stefano Crocchianti, Giorgio Tentella, Alessandro Costantini |
| 2012 | ICCSA | A Bond-Bond Portable Approach to Intermolecular Interactions: Simulations for N-methylacetamide and Carbon Dioxide Dimers. | Andrea Lombardi, Noelia Faginas Lago, Antonio Lagan, Fernando Pirani, Stefano Falcinelli |
| 2012 | ICCSA | Efficient Workload Distribution Bridging HTC and HPC in Scientific Computing. | Carlo Manuali, Alessandro Costantini, Antonio Lagan, Marco Cecchi, Antonia Ghiselli, Michele Carpen, Elda Rossi |
| 2012 | ICCSA | Quantum Reactive Scattering Calculations on GPU. | Leonardo Pacifici, Danilo Nalli, Antonio Lagan |
| 2012 | ICCSA | Taxonomy Management in a Federation of Distributed Repositories: A Chemistry Use Case. | Sergio Tasso, Simonetta Pallottelli, Michele Ferroni, Riccardo Bastianini, Antonio Lagan |
| 2012 | ICCSA | Grid Enabled High Level ab initio Electronic Structure Calculations for the N2+N2 Exchange Reaction. | Marco Verdicchio, Leonardo Pacifici, Antonio Lagan |
| 2011 | ICCSA | A Parallel Code for Time Independent Quantum Reactive Scattering on CPU-GPU Platforms. | Ranieri Baraglia, Malko Bravi, Gabriele Capannini, Antonio Lagan, Edoardo Zambonini |
| 2011 | ICCSA | A Fault Tolerant Workflow for CPU Demanding Calculations. | Alessandro Costantini, Osvaldo Gervasi, Antonio Lagan |
| 2011 | ICCSA | An Extension of the Molecular Simulator GEMS to Calculate the Signal of Crossed Beam Experiments. | Antonio Lagan, Nadia Balucani, Stefano Crocchianti, Piergiorgio Casavecchia, Ernesto Garcia, Amaia Saracibar |
| 2011 | ICCSA | A Grid Credit System Empowering Virtual Research Communities Sustainability. | Carlo Manuali, Antonio Lagan |
| 2011 | ICCSA | Time Dependent Quantum Reactive Scattering on GPU. | Leonardo Pacifici, Danilo Nalli, Dimitris Skouteris, Antonio Lagan |
| 2011 | ICCSA | Potential Decomposition in the Multiconfiguration Time-Dependent Hartree Study of the Confined H Atom. | Dimitris Skouteris, Antonio Lagan |
| 2011 | ICCSA | Federation of Distributed and Collaborative Repositories and Its Application on Science Learning Objects. | Sergio Tasso, Simonetta Pallottelli, Riccardo Bastianini, Antonio Lagan |
| 2010 | ICCSA | Porting of GROMACS Package into the Grid Environment: Testing of a New Distribution Strategy. | Alessandro Costantini, Eduardo Gutierrez, Javier Lpez Cacheiro, Aurelio Rodrguez, Osvaldo Gervasi, Antonio Lagan |
| 2010 | ICCSA | Accurate Quantum Dynamics on Grid Platforms: Some Effects of Long Range Interactions on the Reactivity of N + N | Sergio Rampino, Ernesto Garcia, Fernando Pirani, Antonio Lagan |
| 2009 | ICCSA | A Grid Implementation of Direct Semiclassical Calculations of Rate Coefficients. | Alessandro Costantini, Noelia Faginas Lago, Antonio Lagan, Fermn Huarte-Larraaga |
| 2009 | ICCSA | A Grid Implementation of Direct Quantum Calculations of Rate Coefficients. | Alessandro Costantini, Noelia Faginas Lago, Antonio Lagan, Fermn Huarte-Larraaga |
| 2009 | ICCSA | A Grid Implementation of Chimere: Ozone Production in Central Italy. | Antonio Lagan, Stefano Crocchianti, Alessandro Costantini, Monica Angelucci, Marco Vecchiocattivi |
| 2008 | ICCSA | Small Water Clusters: The Cases of Rare Gas-Water, Alkali Ion-Water and Water Dimer. | Margarita Albert, Antonio Aguilar, Massimiliano Bartolomei, David Cappelletti, Antonio Lagan, Josep M. Lucas, Fernando Pirani |
| 2008 | ICCSA | Investigation of Propane and Methane Bulk Properties Structure Using Two Different Force Fields. | Alessandro Costantini, Antonio Lagan |
| 2008 | ICCSA | A Comparison of the Isotope Effect for the N + N2 Reaction Calculated on Two Potential Energy Surfaces. | Sergio Rampino, Dimitris Skouteris, Antonio Lagan, Ernesto Garcia |
| 2008 | ICCSA | Grid Computing in Time-Dependent Quantum Reactive Dynamics. | Amaia Saracibar, Carlos Snchez, Ernesto Garcia, Antonio Lagan, Dimitris Skouteris |
| 2008 | ICCSA | Implementation of the ABC Quantum Mechanical Reactive Scattering Program on the EGEE Grid Platform. | Dimitris Skouteris, Alessandro Costantini, Antonio Lagan, Gergely Sipos, kos Balask, Pter Kacsuk |
| 2007 | ICCS | FITTING: A Portal to Fit Potential Energy Functionals to | Leonardo Pacifici, Leonardo Arteconi, Antonio Lagan |
| 2007 | ICCSA | An alternative distribution model for the Molecular Dynamics study of liquid Propane on a grid platform. | Alessandro Costantini, Antonio Lagan, Leonardo Pacifici, Osvaldo Gervasi |
| 2007 | ICCSA | Quantum vs Semiclassical Dynamics Approaches from highly symmetric to asymmetric reactions. | Noelia Faginas Lago, Antonio Lagan, Fermn Huarte-Larraaga |
| 2007 | ICCSA | A Molecular Dynamics Study of Zirconium Phosphate Membranes. | Massimiliano Porrini, Antonio Lagan |
| 2006 | ICCSA | Atom-Bond Additive Potentials for Benzene-Rare Gas Clusters. | Margarita Albert, Antonio Lagan, Fernando Pirani, Massimiliano Porrini, David Cappelletti |
| 2006 | ICCSA | A Web Based Application to Fit Potential Energy Functionals to ab Initio Values. | Leonardo Arteconi, Antonio Lagan, Leonardo Pacifici |
| 2006 | ICCSA | Parallel Calculation of Propane Bulk Properties. | Alessandro Costantini, Antonio Lagan, Fernando Pirani |
| 2006 | ICCSA | Immersive Molecular Virtual Reality Based on X3D and Web Services. | Osvaldo Gervasi, Sergio Tasso, Antonio Lagan |
| 2006 | ICCSA | On the Structuring of the Computational Chemistry Virtual Organization COMPCHEM. | Antonio Lagan, Antonio Riganelli, Osvaldo Gervasi |
| 2006 | ICCSA | Study of the Passage of an H | Dimitris Skouteris, Antonio Lagan |
| 2006 | ICCSA | Computing Molecular Energy Surfaces on a Grid. | Loriano Storchi, Francesco Tarantelli, Antonio Lagan |
| 2005 | ICCSA | A Molecular Dynamics Study of Ion Permeability Through Molecular Pores. | Leonardo Arteconi, Antonio Lagan |
| 2005 | ICCSA | Ab Initio and Empirical Atom Bond Formulation of the Interaction of the Dimethylether-Ar System. | Alessandro Costantini, Antonio Lagan, Fernando Pirani, Assimo Maris, Walther Caminati |
| 2005 | ICCSA | Integrating Learning and Assessment Using the Semantic Web. | Osvaldo Gervasi, Riccardo Catanzani, Antonio Riganelli, Antonio Lagan |
| 2005 | ICCSA | ELCHEM: A Metalaboratory to Develop Grid e-Learning Technologies and Services for Chemistry. | Antonio Lagan, Antonio Riganelli, Osvaldo Gervasi, P. Yates, K. Wahala, R. Salzer, E. Varella, Johannes Froehlich |
| 2005 | ICCSA | Thermal Rate Coefficients for the N+N | Noelia Faginas Lago, Antonio Lagan, Ernesto Garcia, X. Gimenez |
| 2005 | ICCSA | Virtual Chemical Laboratories and Their Management on the Web. | Antonio Riganelli, Osvaldo Gervasi, Antonio Lagan, Johannes Froehlich |
| 2004 | ICCSA | Bond Order Potentials for a priori Simulations of Polyatomic Reactions. | Ernesto Garcia, Carlos Snchez, Margarita Albert, Antonio Lagan |
| 2004 | ICCSA | EoL: A Web-Based Distance Assessment System. | Osvaldo Gervasi, Antonio Lagan |
| 2004 | ICCSA | Virtual Reality Applied to Molecular Sciences. | Osvaldo Gervasi, Antonio Riganelli, Antonio Lagan |
| 2004 | ICCSA | Fine Grain Parallelization of a Discrete Variable Wavepacket Calculation Using ASSIST-CL. | Stefano Gregori, Sergio Tasso, Antonio Lagan |
| 2004 | ICCSA | Towards a Full Dimensional Exact Quantum Calculation of the Li + HF Reactive Cross Section. | Antonio Lagan, Stefano Crocchianti, Valentina Piermarini |
| 2004 | ICCSA | A Time Dependent Study of the Nitrogen Atom Nitrogen Molecule Reaction. | Antonio Lagan, Leonardo Pacifici, Dimitris Skouteris |
| 2004 | ICCSA | Molecular Mechanics and Dynamics Calculations to Bridge Molecular Structure Information and Spectroscopic Measurements on Complexes of Aromatic Compounds. | G. Pietraperzia, R. Chelli, M. Becucci, Antonio Riganelli, Margarita Albert, Antonio Lagan |
| 2003 | ICCS | Parallel Models for a Discrete Variable Wavepacket Propagation. | Daniele Bellucci, Sergio Tasso, Antonio Lagan |
| 2003 | ICCS | Initial Value Semiclassical Approaches to Reactive and Non Reactive Transition Probabilities. | Noelia Faginas Lago, Antonio Lagan |
| 2003 | ICCS | A Multiscale Virtual Reality Approach to Chemical Experiments. | Antonio Riganelli, Osvaldo Gervasi, Antonio Lagan, Margarita Albert |
| 2003 | ICCS | Linear Algebra Computation Benchmarks on a Model Grid Platform. | Loriano Storchi, Carlo Manuali, Osvaldo Gervasi, Giuseppe Vitillaro, Antonio Lagan, Francesco Tarantelli |
| 2002 | ICCS | Fine Grain Parallelism for Discrete Variable Approaches to Wavepacket Calculations. | Daniele Bellucci, Sergio Tasso, Antonio Lagan |
| 2002 | ICCS | Towards a GRID Based Portal for an a Priori Molecular Simulation of Chemical Reactivity. | Osvaldo Gervasi, Antonio Lagan, Matteo Lobbiani |
| 2002 | ICCS | Parallel Approaches to the Integration of the Differential Equations for Reactive Scattering. | Valentina Piermarini, Leonardo Pacifici, Stefano Crocchianti, Antonio Lagan |
| 2002 | ICCS | A Molecular Dynamics Study of the Benzene... Ar | Antonio Riganelli, M. Memelli, Antonio Lagan |
| 2001 | ICCS | Parallel Methods in Time Dependent Approaches to Reactive Scattering Calculations. | Valentina Piermarini, Leonardo Pacifici, Stefano Crocchianti, Antonio Lagan, Giuseppina D'Agosto, Sergio Tasso |
| 2000 | PDPTA | Parallelism and granularity in time dependent approaches to reactive scattering calculations. | Valentina Piermarini, Antonio Lagan, Gabriel G. Balint-Kurti, Lorna Smith, Robert J. Allan |