Assessment of tautomer distribution using the condensed reaction graph approach T. R. GimadievT. I. MadzhidovA. Varnek OriginalPaper 29 January 2018 Pages: 401 - 414
Enabling the hypothesis-driven prioritization of ligand candidates in big databases: Screenlamp and its application to GPCR inhibitor discovery for invasive species control Sebastian RaschkaAnne M. ScottLeslie A. Kuhn OriginalPaper 30 January 2018 Pages: 415 - 433
Disruptor of telomeric silencing 1-like (DOT1L): disclosing a new class of non-nucleoside inhibitors by means of ligand-based and structure-based approaches Manuela SabatinoDante RotiliRino Ragno OriginalPaper 15 January 2018 Pages: 435 - 458
An insight to the molecular interactions of the FDA approved HIV PR drugs against L38L↑N↑L PR mutant Zainab K. SanusiThavendran GovenderBahareh Honarparvar OriginalPaper 03 February 2018 Pages: 459 - 471
Structure-based drug design, synthesis and biological assays of P. falciparum Atg3–Atg8 protein–protein interaction inhibitors Stefania VillaLaura LegnaniGiovanni Grazioso OriginalPaper 30 January 2018 Pages: 473 - 486
Impact of graphene-based nanomaterials (GBNMs) on the structural and functional conformations of hepcidin peptide Krishna P. SinghLokesh BawejaShailendra K. Gupta OriginalPaper 03 February 2018 Pages: 487 - 496