The use of a quantitative structure-activity relationship (QSAR) model to predict GABA-A receptor binding of newly emerging benzodiazepines [PDF]
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
Uncovering the Corona Virus Map Using Deep Entities and Relationship Models [PDF]
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
Casework applications of probabilistic genotyping methods for DNA mixtures that allow relationships between contributors [PDF]
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
Relationship Oriented Affordance Learning through Manipulation Graph Construction [PDF]
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]
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]
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
NutriFD: Proving the medicinal value of food nutrition based on food-disease association and treatment networks [PDF]
There is rising evidence of the health benefit associated with specific dietary interventions. Current food-disease databases focus on associations and treatment relationships but haven't provided a reasonable assessment of the strength of the relationship, and lack of attention on food nutrition.
arxiv
Quantum Kolmogorov Complexity and Information-Disturbance Theorem [PDF]
In this paper, a representation of the information-disturbance theorem based on the quantum Kolmogorov complexity that was defined by P. Vitanyi has been examined. In the quantum information theory, the information-disturbance relationship, which treats the trade-off relationship between information gain and its caused disturbance, is a fundamental ...
arxiv +1 more source
Quantitative Structure-Activity Relationship Analysis of the Anticonvulsant Activity of Some Benzylacetamides Based on Genetic Algorithm-Based Multiple Linear Regression [PDF]
Purpose: To develop the quantitative structure-activity relationship (QSAR) for predicting the anticonvulsant activity of α-substituted acetamido-N-benzylacetamide derivatives.Methods: AM1 semiempirical quantum chemical calculation method was used
Ardakani, SS, Marjani, M, Najafi, A
core +2 more sources
Recurrence and algorithmic information [PDF]
In this paper we initiate a somewhat detailed investigation of the relationships between quantitative recurrence indicators and algorithmic complexity of orbits in weakly chaotic dynamical systems. We mainly focus on examples.
arxiv +1 more source