The use of a quantitative structure-activity relationship (QSAR) model to predict GABA-A receptor binding of newly emerging benzodiazepines [PDF]
, 2018 The illicit market for new psychoactive substances is forever expanding. Benzodiazepines and their derivatives are one of a number of groups of these substances and thus far their number has grown year upon year.
Haegeman, Caroline +4 more
core +4 more sources
Drug Design, Development and Therapy, 2018 Isnatin Miladiyah,1,2 Jumina Jumina,3 Sofia Mubarika Haryana,4 Mustofa Mustofa5 1Pharmacology Department, Faculty of Medicine, Islamic University of Indonesia, 2Doctorate Program of Medical Science and Health, Faculty of Medicine, 3Chemistry Department,
Miladiyah I +3 more
doaj
Synthesis, Characterization, and Antifungal Evaluation of Thiolactomycin Derivatives
Engineering, 2020 5-Substituted benzylidene 3-acylthiotetronic acids are antifungal. A series of 3-acylthiotetronic acid derivatives with varying substitutions at the 5-position were designed, synthesized, and characterized, based on the binding pose of 3-acyl thiolactone
Pei Lv +5 more
doaj
Molecules, 2020 Tuberculosis, caused by Mycobacterium tuberculosis (Mtb), remains one of the top ten causes of death worldwide and the main cause of mortality from a single infectious agent.
Cátia Teixeira +4 more
doaj +1 more source
The effects of cinnamaldehyde and eugenol on human adipose-derived mesenchymal stem cells viability, growth and differentiation: a cheminformatics and in vitro study [PDF]
Avicenna Journal of Phytomedicine, 2016 Objective: The aim of this study was to estimate the cheminformatics and qualitative structure-activity relationship (QSAR) of cinnamaldehyde and eugenol.
Abdorrahim Absalan +3 more
doaj +1 more source
Casework applications of probabilistic genotyping methods for DNA mixtures that allow relationships between contributors [PDF]
arXiv, 2020 In both criminal cases and civil cases there is an increasing demand for the analysis of DNA mixtures involving relationships. The goal might be, for example, to identify the contributors to a DNA mixture where the donors may be related, or to infer the relationship between individuals based on a DNA mixture.
arxiv
Uncovering the Corona Virus Map Using Deep Entities and Relationship Models [PDF]
arXiv, 2020 We extract entities and relationships related to COVID-19 from a corpus of articles related to Corona virus by employing a novel entities and relationship model. The entity recognition and relationship discovery models are trained with a multi-task learning objective on a large annotated corpus.
arxiv
Relationship Oriented Affordance Learning through Manipulation Graph Construction [PDF]
arXiv, 2021 In this paper, we propose Manipulation Relationship Graph (MRG), a novel affordance representation which captures the underlying manipulation relationships of an arbitrary scene. To construct such a graph from raw visual observations, a deep nerual network named AR-Net is introduced.
arxiv
Application of support vector machines for prediction of anti-HIV activity of TIBO Derivatives. [PDF]
, 2013 The performance and predictive power of support vector machines (SVM) for regression problems in quantitative structure-activity relationship were investigated.
Darnag, Rachid +2 more
core +1 more source
Investigations on Inhibitors of Hedgehog Signal Pathway: A Quantitative Structure-Activity Relationship Study [PDF]
, 2011 The hedgehog signal pathway is an essential agent in developmental patterning, wherein the local concentration of the Hedgehog morphogens directs cellular differentiation and expansion.
Abdoa +46 more
core +3 more sources