Optimization of parameters for semiempirical methods V: Modification of NDDO approximations and application to 70 elements James J. P. Stewart Original Paper Open access 09 September 2007 Pages: 1173 - 1213
Ab initio and DFT study of the inner mechanism and dynamic stereochemistry of electrophilic addition reaction of bromine to bisbenzotetracyclo[6.2.2.23,6.02,7]tetradeca-4,9,11,13-tetraene Rza Abbasoglu Original Paper 15 September 2007 Pages: 1215 - 1220
Studies of the interaction of tetramethylcucurbit[6]uril and 5,5′-dimethyl-2,2′-bipyridyl hydrochloride Hang CongYun-Jie ZhaoQian-Jiang Zhu Original Paper 05 October 2007 Pages: 1221 - 1226
Density functional theory characterisation of 4-hydroxyazobenzene Benoit MinisiniGuillaume FayetJean François Bardeau Original Paper 05 October 2007 Pages: 1227 - 1235
Homology modeling and examination of the effect of the D92E mutation on the H5N1 nonstructural protein NS1 effector domain Minyong LiBinghe Wang Original Paper 05 October 2007 Pages: 1237 - 1244
π-π stacking tackled with density functional theory Marcel SwartTushar van der WijstF. Matthias Bickelhaupt Original Paper Open access 15 September 2007 Pages: 1245 - 1257