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The 3D-QSAR study of 110 diverse, dual binding, acetylcholinesterase inhibitors based on alignment independent descriptors (GRIND-2). The effects of conformation on predictive power and interpretability of the models
| Title: | The 3D-QSAR study of 110 diverse, dual binding, acetylcholinesterase inhibitors based on alignment independent descriptors (GRIND-2). The effects of conformation on predictive power and interpretability of the models | Authors: | Vitorović-Todorović, Maja D.   ; Cvijetić, Ilija ; Juranić, Ivan O.; Drakulić, Branko J. |
Issue Date: | 2012 | Publication: | Journal of Molecular Graphics and Modelling | ISSN: | 1093-3263 Journal of Molecular Graphics and Modelling Search Idenfier |
Publisher: | Elsevier Science Inc, New York | Type: | Article | Collation: | vol. 38 str. 194-210 | DOI: | 10.1016/j.jmgm.2012.08.001 | WoS-ID: | 000313392800020 | Scopus-ID: | 2-s2.0-84867405904 | PMID: | 23073222 | URI: | https://cherry.chem.bg.ac.rs/handle/123456789/1574 https://enauka.gov.rs/handle/123456789/461536 |
Project: | Racionalni dizajn i sinteza biološki aktivnih i koordinacionih jedinjenja i funkcionalnih materijala, relevantnih u (bio)nanotehnologiji (RS-172035) High-Performance Computing Infrastructure for South East Europe's Research Communities (EU-261499) |
M-category: | 21M21 |
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