PaperDensity functional theory approach to thiols and disulfides on gold: Au(111) surface and clustersWanda Andreoni, Alessandro Curioni, et al.International Journal of Quantum Chemistry
PaperAlq 3 : Ab initio calculations of its structural and electronic properties in neutral and charged statesAlessandro Curioni, Mauro Boero, et al.Chemical Physics Letters
PaperThe binding mode of progesterone to its receptor deduced from molecular dynamics simulationsTiziana Mordasini, Alessandro Curioni, et al.ChemBioChem
PaperEquilibrium structures and finite temperature properties of silicon microclusters from ab initio molecular-dynamics calculationsPietro Ballone, Wanda Andreoni, et al.Physical Review Letters
