Comment on “numerical treatment of two-center overlap integrals” Frank E. Harris Short Comment 05 July 2007 Pages: 949 - 950
QSPR modeling of hyperpolarizabilities Alan R. KatritzkyLiliana PacureanuMati Karelson Original Paper 15 June 2007 Pages: 951 - 963
AM1* parameters for copper and zinc Hakan KayiTimothy Clark Original Paper 15 June 2007 Pages: 965 - 979
Calculations of the C2 fragmentation energies of higher fullerenes C80 and C82 Grygoriy A. DolgonosGilles H. Peslherbe Original Paper 23 June 2007 Pages: 981 - 986
Docking studies on kinesin spindle protein inhibitors: an important cooperative ‘minor binding pocket’ which increases the binding affinity significantly Cheng JiangYadong ChenQidong You Original Paper 23 June 2007 Pages: 987 - 992
3D-QSAR studies on fluoropyrrolidine amides as dipeptidyl peptidase IV inhibitors by CoMFA and CoMSIA Juan ZengGuixia LiuHualiang Jiang Original Paper 06 July 2007 Pages: 993 - 1000
Investigation of the intermolecular proton transfer in the supersystems adenine-methanol/ethanol/i-propanol: MP2 and DFT levels study Vassil B. DelchevIvan G. ShterevNikolay T. Kochev Original Paper 13 July 2007 Pages: 1001 - 1008
The platinum-olefin binding energy in series of (PH3)2Pt(olefin) complexes - a theoretical study David KarhánekPetr KačerLibor Červený Original Paper 14 July 2007 Pages: 1009 - 1016
On the relative stabilities of the alkali cations 222 cryptates in the gas phase and in water-methanol solution Elisa S. LeiteSidney R. SantanaRicardo L. Longo Original Paper 14 July 2007 Pages: 1017 - 1025
Aromaticity and electronic properties of Heterosuperbenzene (Heterohexabenzocoronene) Roberto Salcedo Original Paper 17 July 2007 Pages: 1027 - 1031