# International Journal of Quantum Chemistry

International Journal of Quantum Chemistry > 110 > 1 > 257 - 269

International Journal of Quantum Chemistry > 110 > 1 > 67 - 76

International Journal of Quantum Chemistry > 110 > 1 > 230 - 232

International Journal of Quantum Chemistry > 110 > 1 > 25 - 37

International Journal of Quantum Chemistry > 110 > 1 > 120 - 126

International Journal of Quantum Chemistry > 110 > 1 > 127 - 137

*V*is small, the path length grows exponentially as

*V*decreases. In this case, the state of a moving soliton is quasisteady. In the presence of dispersion determined...

International Journal of Quantum Chemistry > 110 > 1 > 252 - 256

*Nature*1988, 333, 816). Further works, [(

*Medical Hypotheses*2000, 54, 33), (

*Rivista di Biologia/Biology Forum 97*, 2004, 169)], showed...

International Journal of Quantum Chemistry > 110 > 1 > 195 - 201

*n, n*)—zigzag (2

*n*, 0)—armchair (

*n*,

*n*) carbon nanotubes with different lengths of the middle section and infinitely long ends. It is shown that the (

*n, n*)/(2

*n*, 0)/(

*n, n*) segment, when

*n*is not a multiple of 3, behaves...

International Journal of Quantum Chemistry > 110 > 1 > 46 - 61

International Journal of Quantum Chemistry > 110 > 1 > 77 - 82

_{2}PO

_{4}(KDP) and its deuteroanalogue are studied. The tunneling integrals Ω and the parameters of the effective coupling of protons/deuterons

*U*,

*V*(the Ising parameters) are calculated for these materials with the 3d network of H/D‐bonds. Using the obtained

*U*,

*V*and Ω values in the frames of molecular...

International Journal of Quantum Chemistry > 110 > 1 > 104 - 119

International Journal of Quantum Chemistry > 110 > 1 > 62 - 66

International Journal of Quantum Chemistry > 110 > 1 > 138 - 147

International Journal of Quantum Chemistry > 110 > 1 > 38 - 45

International Journal of Quantum Chemistry > 110 > 1 > 11 - 24

International Journal of Quantum Chemistry > 110 > 1 > 161 - 176

*N*‐(2‐dimethylamino)ethyl]‐acridine‐4‐carboxamide (9‐amino‐DACA). The automated docking of ligands into the constructed DNA‐targets produced...

International Journal of Quantum Chemistry > 110 > 1 > 177 - 194

International Journal of Quantum Chemistry > 110 > 1 > 233 - 241