Quinoline alkaloids as intercalative topoisomerase inhibitors Kendall G. BylerChen WangWilliam N. Setzer Original Paper 08 May 2009 Pages: 1417 - 1426
Macrocyclic conjugation in N-fused porphyrins and related species Jun-ichi AiharaMasakazu Makino Original Paper 08 May 2009 Pages: 1427 - 1433
Experimental and theoretical investigation of the molecular and electronic structure of 5-(4-aminophenyl)-4-(3-methyl-3-phenylcyclobutyl)thiazol-2-amine Namık ÖzdemirMuharrem DinçerOrhan Büyükgüngör Original Paper 08 May 2009 Pages: 1435 - 1445
An ab initio quantum mechanical drug designing procedure: application to the design of balanced dual ACE/NEP inhibitors Nishi K. RaoArpita YadavSanjeev Kumar Singh Original Paper 09 May 2009 Pages: 1447 - 1462
Use of molecular modeling, docking, and 3D-QSAR studies for the determination of the binding mode of benzofuran-3-yl-(indol-3-yl)maleimides as GSK-3β inhibitors Ki Hwan KimIrina GaisinaAlan P. Kozikowski Original Paper 14 May 2009 Pages: 1463 - 1479
Covalent complexes of proteasome model with peptide aldehyde inhibitors MG132 and MG101: docking and molecular dynamics study Siwei ZhangYawei ShiLihe Zhang Original Paper 14 May 2009 Pages: 1481 - 1490
GoLoco motif proteins binding to Gαi1: insights from molecular simulations Kamil Khafizov Original Paper Open access 14 May 2009 Pages: 1491 - 1499
Molecular dynamics simulations and MM–PBSA calculations of the lectin from snowdrop (Galanthus nivalis) Zhen LiuYizheng Zhang Original Paper 17 May 2009 Pages: 1501 - 1507
DFT-based QSAR study of alkanols and alkanthiols using the conductor-like polarizable continuum model (CPCM) Khaled AziziMohammad Ali SafarpourAhmad Reza Mehdipour Original Paper 22 May 2009 Pages: 1509 - 1515
A 3-D model of tumor progression based on complex automata driven by particle dynamics Rafał WcisłoWitold DzwinelArkadiusz Z. Dudek Original Paper 23 May 2009 Pages: 1517 - 1539
Erratum and answer to the comment by Harris on: Numerical treatment of two-center overlap integrals (J Mol Mod, 12,213–220, 2006) Hassan Safouhi Short Comment 16 May 2009 Pages: 1541 - 1543
Low-frequency vibrational modes and infrared absorbance of red, blue and green opsin Saravana Prakash ThirumuruganandhamHerbert M. Urbassek Erratum 01 September 2009 Pages: 1545 - 1545