Citation: R. Improta et al., Conformational behavior of macromolecules in solution. Homopolypeptides ofalpha-aminoisobutyric acid as test cases, MACROMOLEC, 34(21), 2001, pp. 7550-7557
Citation: M. Cossi et al., Polarizable dielectric model of solvation with inclusion of charge penetration effects, J CHEM PHYS, 114(13), 2001, pp. 5691-5701
Authors:
Adamo, C
Heitzmann, M
Meilleur, F
Rega, N
Scalmani, G
Grand, A
Cadet, J
Barone, V
Citation: C. Adamo et al., Interplay of intrinsic and environmental effects on the magnetic properties of free radicals issuing from H-atom addition to cytosine, J AM CHEM S, 123(29), 2001, pp. 7113-7117
Authors:
Nielsen, PA
Norrby, PO
Liljefors, T
Rega, N
Barone, V
Citation: Pa. Nielsen et al., Quantum mechanical conformational analysis of beta-alanine zwitterion in aqueous solution, J AM CHEM S, 122(13), 2000, pp. 3151-3155
Citation: V. Barone et al., Ring-opening reaction of cyclobutene radical cation: Effect of solvent on competing pathways, J PHYS CH A, 103(2), 1999, pp. 217-219
Citation: N. Rega et al., Improving performance of polarizable continuum model for study of large molecules in solution, J COMPUT CH, 20(11), 1999, pp. 1186-1198
Citation: M. D'Ischia et al., Medium-dependent competitive pathways in the reactions of polyunsaturated fatty acids with nitric oxide in the presence of oxygen. Structural characterisation of nitration products and a theoretical insight, TETRAHEDRON, 55(30), 1999, pp. 9297-9308
Authors:
Rega, N
Cossi, M
Barone, V
Pomelli, CS
Tomasi, J
Citation: N. Rega et al., Toward an effective and reliable representation of solvent effects in the study of biochemical systems, INT J QUANT, 73(2), 1999, pp. 219-227