Modeling the excitation wavelengths (λex) of boronic acids Minyong LiNanting NiYanqing Zhang Original Paper 20 March 2008 Pages: 441 - 449
Probing the interactions of the solvated electron with DNA by molecular dynamics simulations: bromodeoxyuridine substituted DNA Tsvetan G. GantchevDarel J. Hunting Original Paper 15 April 2008 Pages: 451 - 464
Geometric and electronic structures of new endohedral fullerenes: Eu@C72 Mei ChiZhuxia ZhangBingshe Xu Original Paper 15 April 2008 Pages: 465 - 470
SAR comparative studies on pyrimido[4,5-b][1,4] benzothiazine derivatives as 15-lipoxygenase inhibitors, using ab initio calculations Mehdi BakavoliHamid SadeghianMohsen Nikpour Original Paper 19 April 2008 Pages: 471 - 478
Optimization of cutting schemes for the evaluation of molecular electrostatic potentials in proteins via Moving-Domain QM/MM Lochana C. MenikarachchiJosé A. Gascón Original Paper 22 April 2008 Pages: 1 - 9
Electronic properties of some nitrobenzo[a]pyrene isomers: a possible relationship to mutagenic activity Vito LibrandoAndrea AlparoneGaetano Tomaselli Original Paper 26 April 2008 Pages: 489 - 497
Application of the PM6 method to modeling the solid state James J. P. Stewart Original Paper Open access 01 May 2008 Pages: 499 - 535
Comparing the electronic properties and docking calculations of heme derivatives on CYP2B4 Jessica E. Mendieta-WejebeMartha C. Rosales-HernándezJosé Correa-Basurto Original Paper 14 May 2008 Pages: 537 - 545