| 2006 |
|---|
| 9 | EE | Carles Curutchet,
Modesto Orozco,
F. Javier Luque,
Benedetta Mennucci,
Jacopo Tomasi:
Dispersion and repulsion contributions to the solvation free energy: Comparison of quantum mechanical and classical approaches in the polarizable continuum model.
Journal of Computational Chemistry 27(15): 1769-1780 (2006) |
| 2004 |
|---|
| 8 | EE | Luca Frediani,
Roberto Cammi,
Christian Silvio Pomelli,
Jacopo Tomasi,
Kenneth Ruud:
New developments in the symmetry-adapted algorithm of the Polarizable Continuum Model.
Journal of Computational Chemistry 25(3): 375-385 (2004) |
| 2001 |
|---|
| 7 | EE | Christian Silvio Pomelli,
Jacopo Tomasi,
Roberto Cammi:
A Symmetry adapted tessellation of the GEPOL surface: applications to molecular properties in solution.
Journal of Computational Chemistry 22(12): 1262-1272 (2001) |
| 1999 |
|---|
| 6 | EE | Christian Silvio Pomelli,
Jacopo Tomasi,
Maurizio Cossi,
Vincenzo Barone:
Effective generation of molecular cavities in polarizable continuum model by DefPol procedure.
Journal of Computational Chemistry 20(16): 1693-1701 (1999) |
| 1998 |
|---|
| 5 | EE | Christian Silvio Pomelli,
Jacopo Tomasi:
DefPol: New procedure to build molecular surfaces and its use in continuum solvation methods.
Journal of Computational Chemistry 19(15): 1758-1776 (1998) |
| 4 | EE | Vincenzo Barone,
Maurizio Cossi,
Jacopo Tomasi:
Geometry optimization of molecular structures in solution by the polarizable continuum model.
Journal of Computational Chemistry 19(4): 404-417 (1998) |
| 3 | EE | Maurizio Cossi,
Benedetta Mennucci,
Jesús Pitarch,
Jacopo Tomasi:
Correction of cavity-induced errors in polarization charges of continuum solvation models.
Journal of Computational Chemistry 19(8): 833-846 (1998) |
| 1995 |
|---|
| 2 | | Elena L. Coitiño,
Jacopo Tomasi,
Roberto Cammi:
On the Evaluation of the Solvent Polarization Apparent Charges in the Polarizable Contnuum Model: A New Formulation.
Journal of Computational Chemistry 16(1): 20-30 (1995) |
| 1 | | Roberto Cammi,
Jacopo Tomasi:
Remarks on the Use of the Apparent Surface Charges /ASC) Methods in Solvation Problems: Iterative versus Matrix-Inversion Procedures and the Renormalization of the Apparent Charges.
Journal of Computational Chemistry 16(12): 1449-1458 (1995) |
