Results 81 to 90 of about 1,549,507 (219)
The Scientific World Journal, 2009 Quantitative structure-activity relationship (qSAR) models are used to understand how the structure and activity of chemical compounds relate. In the present study, 37 carboquinone derivatives were evaluated and two different qSAR models were developed ...
Sorana D. Bolboaca, Lorentz Jäntschi
doaj +1 more source
QSAR analyses of Octahydroquinazolinone for insecticidal activity against spodoptera litura and its in-silico validation using molecular Docking study. [PDF]
, 2017 In order to establish a quantitative structure-activity relationship (QSAR) for Insecticide activity against spodoptera litura, we have, first, studied a series of 14 substituted Octahydroquinazolinone and derivatives by using Density functional theory ...
Benlyass, M. +5 more
core +2 more sources
The Traveling Salesman Theorem for Jordan Curves in Hilbert Space [PDF]
arXiv, 2021 Given a metric space $X$, an Analyst's Traveling Salesman Theorem for $X$ gives a quantitative relationship between the length of a shortest curve containing any subset $E\subseteq X$ and a multi-scale sum measuring the ``flatness'' of $E$. The first such theorem was proven by Jones for $X = \mathbb{R}^2$ and extended to $X = \mathbb{R}^n$ by Okikiolu,
arxiv
Structure-activity relationships based on 3D-QSAR CoMFA/CoMSIA and design of aryloxypropanol-amine agonists with selectivity for the human β3-adrenergic receptor and anti-obesity and anti-diabetic profiles [PDF]
, 2018 Indexación: Scopus.Acknowledgments: This work was supported by FONDECYT No. 11130701. We would also like to thank fDoTr CthLeafbr efeora vthaeil afrbeilei tayvoafiltahbeilsitoyf towfa trheer seoqfutwireadret orecqaulciureladt etothcealAcuDla(thet ttph:e/
Andrades-Lagos, J. +7 more
core +2 more sources
QSAR MODELING OF ANTIBACTERIAL ACTIVITY OF SOME BENZIMIDAZOLE DERIVATIVES [PDF]
Chemical Industry and Chemical Engineering Quarterly, 2011 A quantitative structure-activity relationship (QSAR) study has been carried out for a training set of 12 benzimidazole derivatives to correlate and predict the antibacterial activity of studied compounds against Gram-negative bacteria Pseudomonas ...
SANJA O. PODUNAVAC-KUZMANOVIĆ +1 more
doaj
Indonesian Journal of Chemistry, 2013 Study on anti-HIV activity of diarylaniline derivative compounds by using quantitative structure-activity relationship (QSAR) has been done. The compounds structure and their anti-HIV activities were obtained from literature.
Ihsanul Arief +2 more
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ACI Avances en Ciencias e Ingenierías, 2014 The aim of this work was the comparison between κ-Nearest Neighbors (κ-NN) and Counterpropagation Artificial Neural network (CP-ANN) classification methods for modeling the toxicity of a set of 192 organochlorinated, organophosphates ...
Fernando Cárdenas +2 more
doaj +1 more source
Visual Social Relationship Recognition [PDF]
arXiv, 2018 Social relationships form the basis of social structure of humans. Developing computational models to understand social relationships from visual data is essential for building intelligent machines that can better interact with humans in a social environment. In this work, we study the problem of visual social relationship recognition in images.
arxiv
A unified theory of grain growth in polycrystalline materials [PDF]
, 2018 Grain growth is a ubiquitous and fundamental phenomenon observed in the cellular structures with the grain assembly separated by a network of grain boundaries, including metals and ceramics. However, the underlying mechanism of grain growth has remained ambiguous for more than 60 years.
arxiv +1 more source
Quantitative Structure Activity Relationship Studies of Topoisomerase I Inhibitors as Potent Antibreast Cancer Agents [PDF]
, 2013 Topoisomerase I (TOP I) is a valuable molecular target for the development of clinically used anticancer agents. Indenoisoquinolines have emerged as potent topoisomerase I inhibitors.
Anubhuti Pandey +4 more
core +1 more source