[HTML][HTML] … of the endocrine-disrupting effects of diethyl phosphate, a nonspecific metabolite of organophosphorus pesticides, by in vivo and in silico approaches
FW Yang, GP Zhao, FZ Ren, GF Pang, YX Li - Environment International, 2020 - Elsevier
… Additionally, we used in silico molecular docking to study the … and in silico approaches,
which provided further evidence for the comprehensive toxicity assessment of organophosphorus …
which provided further evidence for the comprehensive toxicity assessment of organophosphorus …
A systems-level approach for investigating organophosphorus pesticide toxicity
J Zhu, J Wang, Y Ding, B Liu, W Xiao - Ecotoxicology and environmental …, 2018 - Elsevier
… only through a in silico prediction model considering that the … prediction function of the in
silico approaches to applied to a … target protein of the organophosphorus pesticide. However, …
silico approaches to applied to a … target protein of the organophosphorus pesticide. However, …
… -disrupting effects of organophosphorus pesticide triazophos and its metabolites on endocrine hormones biosynthesis, transport and receptor binding in silico
FW Yang, YX Li, FZ Ren, J Luo, GF Pang - Food and chemical toxicology, 2019 - Elsevier
… a widely used organophosphorus insecticide in developing … of this study involved computational
approaches to discover … proteins using molecular docking in silico. We found that TAP, …
approaches to discover … proteins using molecular docking in silico. We found that TAP, …
[HTML][HTML] New insights on molecular interactions of organophosphorus pesticides with esterases
I Mangas, J Estevez, E Vilanova, TCC França - Toxicology, 2017 - Elsevier
… silico methods have generated new data of the interactions between OPs and esterases and
have established new methods … approach for understanding the organophosphorus toxicity. …
have established new methods … approach for understanding the organophosphorus toxicity. …
Emerging frontiers in microbe-mediated pesticide remediation: Unveiling role of omics and In silico approaches in engineered environment
… approach for pesticide degradation, identification of responsible enzymes/genes, and in silico
approach … systematic pathway response of organophosphates. The broad spectrum use of …
approach … systematic pathway response of organophosphates. The broad spectrum use of …
In silico local QSAR modeling of bioconcentration factor of organophosphate pesticides
P Banjare, B Matore, J Singh, PP Roy - In Silico Pharmacology, 2021 - Springer
… The BCF data of diverse organophosphate (n = 55) was collected from the Pesticide …
organophosphate pesticides and the toxic nature of unknown organophosphate pesticides were …
organophosphate pesticides and the toxic nature of unknown organophosphate pesticides were …
In silico approaches to evaluate the molecular properties of organophosphate compounds to inhibit acetylcholinesterase activity in housefly
P Marimuthu, YJ Lee, BH Kim… - Journal of Biomolecular …, 2019 - Taylor & Francis
… Organophosphate compounds (OPC) have become the primary choice as insecticides and
are … Therefore, combined in silico approaches – pharmacophore-based 3D-QSAR model; …
are … Therefore, combined in silico approaches – pharmacophore-based 3D-QSAR model; …
[HTML][HTML] In Silico Prediction for Intestinal Absorption and Brain Penetration of Chemical Pesticides in Humans
L Chedik, D Mias-Lucquin, A Bruyere… - International Journal of …, 2017 - mdpi.com
… metabolites from 15 different organophosphorus pesticides using the BOILED-… silico
approaches, notably with respect to the realistic conditions of environmental exposure to pesticides, …
approaches, notably with respect to the realistic conditions of environmental exposure to pesticides, …
QSAR analyses of organophosphates for insecticidal activity and its in-silico validation using molecular docking study
… Novel approach of in-silico validation of QSAR models by … The models were subjected to
validation by in-silico method of … studies in computer-aided pesticide designing. The selected …
validation by in-silico method of … studies in computer-aided pesticide designing. The selected …
Rational in silico design of aptamers for organophosphates based on the example of paraoxon
DA Belinskaia, PV Avdonin, PP Avdonin… - … Biology and Chemistry, 2019 - Elsevier
… Poisoning by organophosphates (OPs) takes one of the … was to develop an approach to
rational in silico design of … of an aptamer binding organophosphorus pesticides, its three-…
rational in silico design of … of an aptamer binding organophosphorus pesticides, its three-…
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