RNA unrestrained molecular dynamics ensemble improves agreement with experimental NMR data compared to single static structure: a test case Robert A. BeckmanDavid MorelandChristine Humblet Original Paper 28 September 2006 Pages: 263 - 279
Towards discovering dual functional inhibitors against both wild type and K103N mutant HIV-1 reverse transcriptases: molecular docking and QSAR studies on 4,1-benzoxazepinone analogues Zhenshan ZhangMingyue ZhengHualiang Jiang Original Paper 08 August 2006 Pages: 281 - 293
Pharmacophore model for bile acids recognition by the FPR receptor Cristina FerrariAntonio MacchiaruloRoberto Pellicciari Original Paper 14 September 2006 Pages: 295 - 303
Three dimensional model of severe acute respiratory syndrome coronavirus helicase ATPase catalytic domain and molecular design of severe acute respiratory syndrome coronavirus helicase inhibitors Marcin HoffmannKrystian EitnerAndrzej Kolinski Original Paper 14 September 2006 Pages: 305 - 319
Do benzodiazepines mimic reverse-turn structures? Masayuki HataGarland R. Marshall Original Paper 14 September 2006 Pages: 321 - 331
A novel workflow for the inverse QSPR problem using multiobjective optimization Nathan BrownBen McKayJohann Gasteiger Original Paper 21 September 2006 Pages: 333 - 341