Design of chemical space networks on the basis of Tversky similarity Mengjun WuMartin VogtJürgen Bajorath OriginalPaper 22 December 2015 Pages: 1 - 12
Theoretical studies on the reaction of mono- and ditriflate derivatives of 1,4:3,6-dianhydro-d-mannitol with trimethylamine—Can a quaternary ammonium salt be a source of the methyl group? Justyna BednarkoJustyna WielińskaAndrzej Nowacki OriginalPaper 14 December 2015 Pages: 13 - 26
Computational insights into the interaction mechanism of triazolyl substituted tetrahydrobenzofuran derivatives with H+,K+-ATPase at different pH Hua-Jun LuoJun-Zhi WangKun Zou OriginalPaper 14 December 2015 Pages: 27 - 37
Identification of novel inhibitors for Pim-1 kinase using pharmacophore modeling based on a novel method for selecting pharmacophore generation subsets Rand ShahinLubna SwellmeenMaha Habash OriginalPaper 19 December 2015 Pages: 39 - 68
Unraveling the distinctive features of hemorrhagic and non-hemorrhagic snake venom metalloproteinases using molecular simulations Raoni Almeida de SouzaNatalia DíazDimas Suárez OriginalPaper 16 December 2015 Pages: 69 - 83
New insights into the stereochemical requirements of the bradykinin B2 receptor antagonists binding Cecylia S. LupalaPatricia Gomez-GutierrezJuan J. Perez OriginalPaper 24 December 2015 Pages: 85 - 101