| 1 |
Prototropic equilibria in 4-thiouracil : A combined spectroscopic and ab initio SCF-MO investigation
Rubin YV, Morozov Y, Venkateswarlu D, Leszczynski J
Journal of Physical Chemistry A, 102(12), 2194, 1998 |
| 2 |
Tautomerism and proton transfer in 6-selenoguanine : A post Hartree-Fock level ab initio SCF-MO investigation
Venkateswarlu D, Leszczynski J
Journal of Physical Chemistry A, 102(30), 6161, 1998 |
| 3 |
Matrix-isolation FT-IR studies and ab initio calculations of hydrogen-bonded complexes of molecules modeling cytosine or isocytosine tautomers. 6. Experimental observation of a water-induced tautomeric shift for 2-hydroxypyrimidine and 5-bromo-2-hydroxypyrimidine
Smets J, Destexhe A, Adamowicz L, Maes G
Journal of Physical Chemistry A, 102(42), 8157, 1998 |
| 4 |
Toward the Prediction of Magnetic Coupling in Molecular-Systems - Hydroxo-Bridged and Alkoxo-Bridged Cu(II) Binuclear Complexes
Ruiz E, Alemany P, Alvarez S, Cano J
Journal of the American Chemical Society, 119(6), 1297, 1997 |
| 5 |
Electronic-Structure of bis(2,4-Pentanedionato-O,O’)Oxovanadium(IV) - A Photoelectron-Spectroscopy, Electronic Spectroscopy, and Ab-Initio Molecular-Orbital Study
Dibella S, Lanza G, Gulino A, Fragala I
Inorganic Chemistry, 35(13), 3885, 1996 |
| 6 |
Molecular-Structure and Vibrational Ir-Spectra of Cytosine and Its Thio and Seleno Analogs by Density-Functional Theory and Conventional Ab-Initio Calculations
Kwiatkowski JS, Leszczynski J
Journal of Physical Chemistry, 100(3), 941, 1996 |
| 7 |
A Density-Functional Study of Tautomerism of Uracil and Cytosine
Estrin DA, Paglieri L, Corongiu G
Journal of Physical Chemistry, 98(22), 5653, 1994 |
