 | 2012 |
| 88 |  | Sergio Rampino,
Noelia Faginas Lago,
Antonio Laganà,
Fermín Huarte-Larrañaga:
An extension of the grid empowered molecular simulator to quantum reactive scattering.
Journal of Computational Chemistry 33(6): 708-714 (2012) |
| 2011 |
| 87 |  | Alessandro Costantini,
Osvaldo Gervasi,
Antonio Laganà:
A Fault Tolerant Workflow for CPU Demanding Calculations.
ICCSA (3) 2011: 387-396 |
| 86 |  | Carlo Manuali,
Antonio Laganà:
A Grid Credit System Empowering Virtual Research Communities Sustainability.
ICCSA (3) 2011: 397-411 |
| 85 |  | Ranieri Baraglia,
Malko Bravi,
Gabriele Capannini,
Antonio Laganà,
Edoardo Zambonini:
A Parallel Code for Time Independent Quantum Reactive Scattering on CPU-GPU Platforms.
ICCSA (3) 2011: 412-427 |
| 84 |  | Leonardo Pacifici,
Danilo Nalli,
Dimitris Skouteris,
Antonio Laganà:
Time Dependent Quantum Reactive Scattering on GPU.
ICCSA (3) 2011: 428-441 |
| 83 |  | Dimitris Skouteris,
Antonio Laganà:
Potential Decomposition in the Multiconfiguration Time-Dependent Hartree Study of the Confined H Atom.
ICCSA (3) 2011: 442-452 |
| 82 |  | Antonio Laganà,
Nadia Balucani,
Stefano Crocchianti,
Piergiorgio Casavecchia,
Ernesto Garcia,
Amaia Saracibar:
An Extension of the Molecular Simulator GEMS to Calculate the Signal of Crossed Beam Experiments.
ICCSA (3) 2011: 453-465 |
| 81 |  | Sergio Tasso,
Simonetta Pallottelli,
Riccardo Bastianini,
Antonio Laganà:
Federation of Distributed and Collaborative Repositories and Its Application on Science Learning Objects.
ICCSA (3) 2011: 466-478 |
| 80 |  | Carlo Manuali,
Antonio Laganà:
GriF: A new collaborative framework for a web service approach to grid empowered calculations.
Future Generation Comp. Syst. 27(3): 315-318 (2011) |
| 2010 |
| 79 |  | Sergio Rampino,
Ernesto Garcia,
Fernando Pirani,
Antonio Laganà:
Accurate Quantum Dynamics on Grid Platforms: Some Effects of Long Range Interactions on the Reactivity of N + N2.
ICCSA (4) 2010: 1-12 |
| 78 |  | Alessandro Costantini,
Eduardo Gutierrez,
Javier López Cacheiro,
Aurelio Rodriguez,
Osvaldo Gervasi,
Antonio Laganà:
Porting of GROMACS Package into the Grid Environment: Testing of a New Distribution Strategy.
ICCSA (4) 2010: 41-52 |
| 77 |  | Carlo Manuali,
Antonio Laganà,
Sergio Rampino:
GriF: A Grid framework for a Web Service approach to reactive scattering.
Computer Physics Communications 181(7): 1179-1185 (2010) |
| 76 |  | Alessandro Costantini,
Eduardo Gutierrez,
Javier López Cacheiro,
Aurelio Rodriguez,
Osvaldo Gervasi,
Antonio Laganà:
On the extension of the grid-empowered molecular science simulator: MD and visualisation tools.
IJWGS 6(2): 141-159 (2010) |
| 75 |  | Sergio Rampino,
Fernando Pirani,
Ernesto Garcia,
Antonio Laganà:
A study of the impact of long range interactions on the reactivity of N + N2 using the Grid Empowered Molecular Simulator GEMS.
IJWGS 6(2): 196-212 (2010) |
| 74 |  | Antonio Laganà,
Alessandro Costantini,
Osvaldo Gervasi,
Noelia Faginas Lago,
Carlo Manuali,
Sergio Rampino:
COMPCHEM: Progress Towards GEMS a Grid Empowered Molecular Simulator and Beyond.
J. Grid Comput. 8(4): 571-586 (2010) |
| 2009 |
| 73 |  | Osvaldo Gervasi,
David Taniar,
Beniamino Murgante,
Antonio Laganà,
Youngsong Mun,
Marina L. Gavrilova:
Computational Science and Its Applications - ICCSA 2009, International Conference, Seoul, Korea, June 29-July 2, 2009, Proceedings, Part I
Springer 2009 |
| 72 |  | Osvaldo Gervasi,
David Taniar,
Beniamino Murgante,
Antonio Laganà,
Youngsong Mun,
Marina L. Gavrilova:
Computational Science and Its Applications - ICCSA 2009, International Conference, Seoul, Korea, June 29-July 2, 2009, Proceedings, Part II
Springer 2009 |
| 71 |  | Alessandro Costantini,
Noelia Faginas Lago,
Antonio Laganà,
Fermín Huarte-Larrañaga:
A Grid Implementation of Direct Quantum Calculations of Rate Coefficients.
ICCSA (2) 2009: 104-114 |
| 70 |  | Antonio Laganà,
Stefano Crocchianti,
Alessandro Costantini,
Monica Angelucci,
Marco Vecchiocattivi:
A Grid Implementation of Chimere: Ozone Production in Central Italy.
ICCSA (2) 2009: 115-129 |
| 69 |  | Alessandro Costantini,
Noelia Faginas Lago,
Antonio Laganà,
Fermín Huarte-Larrañaga:
A Grid Implementation of Direct Semiclassical Calculations of Rate Coefficients.
ICCSA (2) 2009: 93-103 |
| 68 |  | Dimitris Skouteris,
Osvaldo Gervasi,
Antonio Laganà:
A program for performing exact quantum dynamics calculations using cylindrical polar coordinates: A nanotube application.
Computer Physics Communications 180(3): 459-465 (2009) |
| 2008 |
| 67 |  | Osvaldo Gervasi,
Beniamino Murgante,
Antonio Laganà,
David Taniar,
Youngsong Mun,
Marina L. Gavrilova:
Computational Science and Its Applications - ICCSA 2008, International Conference, Perugia, Italy, June 30 - July 3, 2008, Proceedings, Part I
Springer 2008 |
| 66 |  | Osvaldo Gervasi,
Beniamino Murgante,
Antonio Laganà,
David Taniar,
Youngsong Mun,
Marina L. Gavrilova:
Computational Science and Its Applications - ICCSA 2008, International Conference, Perugia, Italy, June 30 - July 3, 2008, Proceedings, Part II
Springer 2008 |
| 65 |  | Margarita Albertí,
Antonio Aguilar,
Massimiliano Bartolomei,
David Cappelletti,
Antonio Laganà,
Josep M. Lucas,
Fernando Pirani:
Small Water Clusters: The Cases of Rare Gas-Water, Alkali Ion-Water and Water Dimer.
ICCSA (1) 2008: 1026-1035 |
| 64 |  | Alessandro Costantini,
Antonio Laganà:
Investigation of Propane and Methane Bulk Properties Structure Using Two Different Force Fields.
ICCSA (1) 2008: 1052-1064 |
| 63 |  | Amaia Saracibar,
Carlos Sánchez,
Ernesto Garcia,
Antonio Laganà,
Dimitris Skouteris:
Grid Computing in Time-Dependent Quantum Reactive Dynamics.
ICCSA (1) 2008: 1065-1080 |
| 62 |  | Sergio Rampino,
Dimitris Skouteris,
Antonio Laganà,
Ernesto Garcia:
A Comparison of the Isotope Effect for the N + N2 Reaction Calculated on Two Potential Energy Surfaces.
ICCSA (1) 2008: 1081-1093 |
| 61 |  | Dimitris Skouteris,
Alessandro Costantini,
Antonio Laganà,
Gergely Sipos,
Ákos Balaskó,
Péter Kacsuk:
Implementation of the ABC Quantum Mechanical Reactive Scattering Program on the EGEE Grid Platform.
ICCSA (1) 2008: 1108-1120 |
| 2007 |
| 60 |  | Massimiliano Porrini,
Antonio Laganà:
A Molecular Dynamics Study of Zirconium Phosphate Membranes.
ICCSA (1) 2007: 295-304 |
| 59 |  | Leonardo Pacifici,
Leonardo Arteconi,
Antonio Laganà:
FITTING: A Portal to Fit Potential Energy Functionals to ab initio Points.
International Conference on Computational Science (1) 2007: 358-365 |
| 2006 |
| 58 |  | Marina L. Gavrilova,
Osvaldo Gervasi,
Vipin Kumar,
Chih Jeng Kenneth Tan,
David Taniar,
Antonio Laganà,
Youngsong Mun,
Hyunseung Choo:
Computational Science and Its Applications - ICCSA 2006, International Conference, Glasgow, UK, May 8-11, 2006, Proceedings, Part I
Springer 2006 |
| 57 |  | Marina L. Gavrilova,
Osvaldo Gervasi,
Vipin Kumar,
Chih Jeng Kenneth Tan,
David Taniar,
Antonio Laganà,
Youngsong Mun,
Hyunseung Choo:
Computational Science and Its Applications - ICCSA 2006, International Conference, Glasgow, UK, May 8-11, 2006, Proceedings, Part II
Springer 2006 |
| 56 |  | Marina L. Gavrilova,
Osvaldo Gervasi,
Vipin Kumar,
Chih Jeng Kenneth Tan,
David Taniar,
Antonio Laganà,
Youngsong Mun,
Hyunseung Choo:
Computational Science and Its Applications - ICCSA 2006, International Conference, Glasgow, UK, May 8-11, 2006, Proceedings, Part III
Springer 2006 |
| 55 |  | Marina L. Gavrilova,
Osvaldo Gervasi,
Vipin Kumar,
Chih Jeng Kenneth Tan,
David Taniar,
Antonio Laganà,
Youngsong Mun,
Hyunseung Choo:
Computational Science and Its Applications - ICCSA 2006, International Conference, Glasgow, UK, May 8-11, 2006, Proceedings, Part IV
Springer 2006 |
| 54 |  | Marina L. Gavrilova,
Osvaldo Gervasi,
Vipin Kumar,
Chih Jeng Kenneth Tan,
David Taniar,
Antonio Laganà,
Youngsong Mun,
Hyunseung Choo:
Computational Science and Its Applications - ICCSA 2006, International Conference, Glasgow, UK, May 8-11, 2006, Proceedings, Part V
Springer 2006 |
| 53 |  | Osvaldo Gervasi,
Sergio Tasso,
Antonio Laganà:
Immersive Molecular Virtual Reality Based on X3D and Web Services.
ICCSA (1) 2006: 212-221 |
| 52 |  | Antonio Laganà,
Antonio Riganelli,
Osvaldo Gervasi:
On the Structuring of the Computational Chemistry Virtual Organization COMPCHEM.
ICCSA (1) 2006: 665-674 |
| 51 |  | Loriano Storchi,
Francesco Tarantelli,
Antonio Laganà:
Computing Molecular Energy Surfaces on a Grid.
ICCSA (1) 2006: 675-683 |
| 50 |  | Leonardo Arteconi,
Antonio Laganà,
Leonardo Pacifici:
A Web Based Application to Fit Potential Energy Functionals to ab Initio Values.
ICCSA (1) 2006: 694-700 |
| 49 |  | Margarita Albertí,
Antonio Laganà,
Fernando Pirani,
Massimiliano Porrini,
David Cappelletti:
Atom-Bond Additive Potentials for Benzene-Rare Gas Clusters.
ICCSA (1) 2006: 721-730 |
| 48 |  | Alessandro Costantini,
Antonio Laganà,
Fernando Pirani:
Parallel Calculation of Propane Bulk Properties.
ICCSA (1) 2006: 738-743 |
| 47 |  | Dimitris Skouteris,
Antonio Laganà:
Study of the Passage of an H+ Ion Along a Carbon Nanotube Using Quantum Wavepacket Dynamics.
ICCSA (1) 2006: 757-762 |
| 2005 |
| 46 |  | Osvaldo Gervasi,
Marina L. Gavrilova,
Vipin Kumar,
Antonio Laganà,
Heow Pueh Lee,
Youngsong Mun,
David Taniar,
Chih Jeng Kenneth Tan:
Computational Science and Its Applications - ICCSA 2005, International Conference, Singapore, May 9-12, 2005, Proceedings, Part I
Springer 2005 |
| 45 |  | Osvaldo Gervasi,
Marina L. Gavrilova,
Vipin Kumar,
Antonio Laganà,
Heow Pueh Lee,
Youngsong Mun,
David Taniar,
Chih Jeng Kenneth Tan:
Computational Science and Its Applications - ICCSA 2005, International Conference, Singapore, May 9-12, 2005, Proceedings, Part II
Springer 2005 |
| 44 |  | Osvaldo Gervasi,
Marina L. Gavrilova,
Vipin Kumar,
Antonio Laganà,
Heow Pueh Lee,
Youngsong Mun,
David Taniar,
Chih Jeng Kenneth Tan:
Computational Science and Its Applications - ICCSA 2005, International Conference, Singapore, May 9-12, 2005, Proceedings, Part III
Springer 2005 |
| 43 |  | Osvaldo Gervasi,
Marina L. Gavrilova,
Vipin Kumar,
Antonio Laganà,
Heow Pueh Lee,
Youngsong Mun,
David Taniar,
Chih Jeng Kenneth Tan:
Computational Science and Its Applications - ICCSA 2005, International Conference, Singapore, May 9-12, 2005, Proceedings, Part IV
Springer 2005 |
| 42 |  | Osvaldo Gervasi,
Cristian Dittamo,
Antonio Laganà:
A Grid Molecular Simulator for E-Science.
EGC 2005: 16-22 |
| 41 |  | Alessandro Costantini,
Antonio Laganà,
Fernando Pirani,
Assimo Maris,
Walther Caminati:
Ab Initio and Empirical Atom Bond Formulation of the Interaction of the Dimethylether-Ar System.
ICCSA (1) 2005: 1046-1053 |
| 40 |  | Noelia Faginas Lago,
Antonio Laganà,
Ernesto Garcia,
X. Gimenez:
Thermal Rate Coefficients for the N+N2 Reaction: Quasiclassical, Semiclassical and Quantum Calculations.
ICCSA (1) 2005: 1083-1092 |
| 39 |  | Leonardo Arteconi,
Antonio Laganà:
A Molecular Dynamics Study of Ion Permeability Through Molecular Pores.
ICCSA (1) 2005: 1093-1100 |
| 38 |  | Antonio Riganelli,
Osvaldo Gervasi,
Antonio Laganà,
Johannes Froehlich:
Virtual Chemical Laboratories and Their Management on the Web.
ICCSA (1) 2005: 905-912 |
| 37 |  | Osvaldo Gervasi,
Riccardo Catanzani,
Antonio Riganelli,
Antonio Laganà:
Integrating Learning and Assessment Using the Semantic Web.
ICCSA (1) 2005: 921-927 |
| 36 |  | Antonio Laganà,
Antonio Riganelli,
Osvaldo Gervasi,
P. Yates,
K. Wahala,
R. Salzer,
E. Varella,
Johannes Froehlich:
ELCHEM: A Metalaboratory to Develop Grid e-Learning Technologies and Services for Chemistry.
ICCSA (1) 2005: 938-946 |
| 2004 |
| 35 |  | Antonio Laganà,
Marina L. Gavrilova,
Vipin Kumar,
Youngsong Mun,
Chih Jeng Kenneth Tan,
Osvaldo Gervasi:
Computational Science and Its Applications - ICCSA 2004, International Conference, Assisi, Italy, May 14-17, 2004, Proceedings, Part I
Springer 2004 |
| 34 |  | Antonio Laganà,
Marina L. Gavrilova,
Vipin Kumar,
Youngsong Mun,
Chih Jeng Kenneth Tan,
Osvaldo Gervasi:
Computational Science and Its Applications - ICCSA 2004, International Conference, Assisi, Italy, May 14-17, 2004, Proceedings, Part II
Springer 2004 |
| 33 |  | Antonio Laganà,
Marina L. Gavrilova,
Vipin Kumar,
Youngsong Mun,
Chih Jeng Kenneth Tan,
Osvaldo Gervasi:
Computational Science and Its Applications - ICCSA 2004, International Conference, Assisi, Italy, May 14-17, 2004, Proceedings, Part III
Springer 2004 |
| 32 |  | Antonio Laganà,
Marina L. Gavrilova,
Vipin Kumar,
Youngsong Mun,
Chih Jeng Kenneth Tan,
Osvaldo Gervasi:
Computational Science and Its Applications - ICCSA 2004, International Conference, Assisi, Italy, May 14-17, 2004, Proceedings, Part IV
Springer 2004 |
| 31 |  | Ernesto Garcia,
Carlos Sánchez,
Margarita Albertí,
Antonio Laganà:
Bond Order Potentials for a priori Simulations of Polyatomic Reactions.
ICCSA (2) 2004: 328-337 |
| 30 |  | Antonio Laganà,
Leonardo Pacifici,
Dimitris Skouteris:
A Time Dependent Study of the Nitrogen Atom Nitrogen Molecule Reaction.
ICCSA (2) 2004: 357-365 |
| 29 |  | G. Pietraperzia,
R. Chelli,
M. Becucci,
Antonio Riganelli,
Margarita Albertí,
Antonio Laganà:
Molecular Mechanics and Dynamics Calculations to Bridge Molecular Structure Information and Spectroscopic Measurements on Complexes of Aromatic Compounds.
ICCSA (2) 2004: 374-382 |
| 28 |  | Antonio Laganà,
Stefano Crocchianti,
Valentina Piermarini:
Towards a Full Dimensional Exact Quantum Calculation of the Li + HF Reactive Cross Section.
ICCSA (2) 2004: 422-431 |
| 27 |  | Stefano Gregori,
Sergio Tasso,
Antonio Laganà:
Fine Grain Parallelization of a Discrete Variable Wavepacket Calculation Using ASSIST-CL.
ICCSA (2) 2004: 437-444 |
| 26 |  | Osvaldo Gervasi,
Antonio Riganelli,
Antonio Laganà:
Virtual Reality Applied to Molecular Sciences.
ICCSA (2) 2004: 827-836 |
| 25 |  | Osvaldo Gervasi,
Antonio Laganà:
EoL: A Web-Based Distance Assessment System.
ICCSA (2) 2004: 854-862 |
| 24 |  | Antonio Laganà,
Noelia Faginas Lago:
Foreword.
Future Generation Comp. Syst. 20(5): 701-702 (2004) |
| 23 |  | Osvaldo Gervasi,
Antonio Laganà:
SIMBEX: a portal for the a priori simulation of crossed beam experiments.
Future Generation Comp. Syst. 20(5): 703-715 (2004) |
| 22 |  | Osvaldo Gervasi,
Antonio Riganelli,
Leonardo Pacifici,
Antonio Laganà:
VMSLab-G: a virtual laboratory prototype for molecular science on the Grid.
Future Generation Comp. Syst. 20(5): 717-726 (2004) |
| 21 |  | Antonio Laganà,
Leonardo Pacifici,
Daniele Bellucci:
Parallelization strategies for quantum reactive scattering codes.
Future Generation Comp. Syst. 20(5): 829-840 (2004) |
| 2003 |
| 20 |  | Loriano Storchi,
Carlo Manuali,
Osvaldo Gervasi,
Giuseppe Vitillaro,
Antonio Laganà,
Francesco Tarantelli:
Linear Algebra Computation Benchmarks on a Model Grid Platform.
International Conference on Computational Science 2003: 297-306 |
| 19 |  | Antonio Riganelli,
Osvaldo Gervasi,
Antonio Laganà,
Margarita Albertí:
A Multiscale Virtual Reality Approach to Chemical Experiments.
International Conference on Computational Science 2003: 324-330 |
| 18 |  | Daniele Bellucci,
Sergio Tasso,
Antonio Laganà:
Parallel Models for a Discrete Variable Wavepacket Propagation.
International Conference on Computational Science 2003: 341-349 |
| 17 |  | Noelia Faginas Lago,
Antonio Laganà:
Initial Value Semiclassical Approaches to Reactive and Non Reactive Transition Probabilities.
International Conference on Computational Science 2003: 357-365 |
| 2002 |
| 16 |  | Valentina Piermarini,
Leonardo Pacifici,
Stefano Crocchianti,
Antonio Laganà:
Parallel Approaches to the Integration of the Differential Equations for Reactive Scattering.
International Conference on Computational Science (3) 2002: 908-917 |
| 15 |  | Daniele Bellucci,
Sergio Tasso,
Antonio Laganà:
Fine Grain Parallelism for Discrete Variable Approaches to Wavepacket Calculations.
International Conference on Computational Science (3) 2002: 918-925 |
| 14 |  | Antonio Riganelli,
M. Memelli,
Antonio Laganà:
A Molecular Dynamics Study of the Benzene... Ar2 Complexes.
International Conference on Computational Science (3) 2002: 926-931 |
| 13 |  | Osvaldo Gervasi,
Antonio Laganà,
Matteo Lobbiani:
Towards a GRID Based Portal for an a Priori Molecular Simulation of Chemical Reactivity.
International Conference on Computational Science (3) 2002: 956-965 |
| 2001 |
| 12 |  | Valentina Piermarini,
Leonardo Pacifici,
Stefano Crocchianti,
Antonio Laganà:
Parallel Models for Reactive Scattering Calculations.
HPCN Europe 2001: 194-203 |
| 11 |  | Valentina Piermarini,
Leonardo Pacifici,
Stefano Crocchianti,
Antonio Laganà,
Giuseppina D'Agosto,
Sergio Tasso:
Parallel Methods in Time Dependent Approaches to Reactive Scattering Calculations.
International Conference on Computational Science (1) 2001: 567-578 |
| 2000 |
| 10 |  | Ranieri Baraglia,
Domenico Laforenza,
Antonio Laganà:
A Web-Based Metacomputing Problem-Solving Environment for Complex Applications.
GRID 2000: 111-122 |
| 9 |  | Valentina Piermarini,
Antonio Laganà,
Gabriel G. Balint-Kurti,
Lorna Smith,
Robert J. Allan:
Parallelism and granularity in time dependent approaches to reactive scattering calculations.
PDPTA 2000 |
| 8 |  | Alessandro Bolloni,
Stefano Crocchianti,
Antonio Laganà:
Time Independent 3D Quantum Reactive Scattering on MIMD Parallel Computers.
PVM/MPI 2000: 338-345 |
| 1999 |
| 7 |  | Ranieri Baraglia,
Renato Ferrini,
Domenico Laforenza,
Antonio Laganà:
Parallel Approaches to a Numerically Intensive Application Using PVM.
PVM/MPI 1999: 364-371 |
| 6 |  | Ranieri Baraglia,
Renato Ferrini,
Domenico Laforenza,
Antonio Laganà:
An optimized task-farm model to integrate reduced dimensionality Schrödinger equations on distributed memory architectures.
Future Generation Comp. Syst. 15(4): 497-512 (1999) |
| 1998 |
| 5 |  | Alessandro Bolloni,
Antonio Riganelli,
Stefano Crocchianti,
Antonio Laganà:
Parallel Quantum Scattering Calculations Applied to the Dynamics of Elementary Reactions.
PVM/MPI 1998: 331-337 |
| 4 |  | Antonio Laganà,
Gaia Grossi,
Antonio Riganelli,
Gianni Ferraro:
A Model for Parallel One Dimensional Eigenvalues and Eigenfunctions Calculations.
PVM/MPI 1998: 364-370 |
| 1997 |
| 3 |  | Ranieri Baraglia,
Renato Ferrini,
Domenico Laforenza,
Antonio Laganà:
Metacomputing to Overcome the Power Limits of a Single Machine.
HPCN Europe 1997: 982-986 |
| 1995 |
| 2 |  | Ranieri Baraglia,
Domenico Laforenza,
Antonio Laganà:
Parallelization strategies for a reduced dimensionality calculation of quantum reactive scattering cross sections on a hybercube machine.
HPCN Europe 1995: 554-561 |
| 1 |  | Antonio Laganà,
Stefano Crocchianti,
Guillermo Ochoa de Aspuru,
Ricardo Gargano,
G. A. Parker:
Parallel Time Independent Quantum Calculations of Atom Diatom Reactivity.
PARA 1995: 361-370 |