discovery studio client v19 (Accelrys)
86
Structured Review
Accelrys
discovery studio client v19
Discovery Studio Client V19, supplied by Accelrys, used in various techniques. Bioz Stars score: 86/100, based on 1 PubMed citations. ZERO BIAS - scores, article reviews, protocol conditions and more
https://www.bioz.com/product/discovery+studio+client+v19/0+1+18287+discovery+studio+v19+visualizer/pm42114567-106-8-12
Average 86 stars, based on 1 article reviews
Discovery Studio Client V19, supplied by Accelrys, used in various techniques. Bioz Stars score: 86/100, based on 1 PubMed citations. ZERO BIAS - scores, article reviews, protocol conditions and more
https://www.bioz.com/product/discovery+studio+client+v19/0+1+18287+discovery+studio+v19+visualizer/pm42114567-106-8-12
Average 86 stars, based on 1 article reviews
discovery studio client v19 - by Bioz Stars,
2026-11
86/100 stars
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other:Article Title: Impact of mycotoxins on placental function: Focus on cyclopiazonic acid, deoxynivalenol, patulin, and zearalenone's metabolites. Article Snippet: Mycotoxins are secondary metabolites produced by fungi and pose significant risks to human and animal health.. This study aimed to determine inhibitory potency of 7 mycotoxins and metabolites (cyclopiazonic acid, deoxynivalenol, patulin, zearalenone, α-zearalenol, β-zearalenol, and β-zearalanol) against human placental 3βhydroxysteroid dehydrogenase 1 (h3β-HSD1) and rat homolog r3β-HSD4, as well as their effects on progesterone output in human JAr cells and perform mechanism and structure-activity relationship analysis.. In placentas, h3βHSD1 is responsible for pregnenolone-to-progesterone conversion. Article Title: Inhibition of human and rat placental 3β-hydroxysteroid dehydrogenases by gallates: Combined experimental, 3D-QSAR, and in silico analysis. Article Snippet: Gallates are extensively utilized as additives in food, pharmaceuticals, and cosmetics.. Despite their widespread use, their impact on the endocrine system remains poorly understood.. This study investigates the potential interaction of gallates with 3β-hydroxysteroid dehydrogenase (3β-HSD), a critical enzyme in placental progesterone synthesis. Article Title: Structural and mechanistic insights into industrial phenolic compounds as potent inhibitors of human and rat 5α-reductase 1. Article Snippet: To further validate the human and rat 5α-R1 structures, the primary sequences between human and rat 5α-R1 enzymes were compared using Biomarker Discovery:Article Title: Elucidating the novel mechanism of organochlorine fungicides in inhibiting human and rat gonadal 3β-hydroxysteroid dehydrogenase via molecular docking and 3D-QSAR analysis. Article Snippet: .. 3D-QSAR pharmacophore generation and validation were conducted using Article Title: Structural determinants of paraben-mediated 11β-hydroxysteroid dehydrogenase 1 inhibition: Integrated mechanistic, kinetic and in silico approaches to cortisol metabolism. Article Snippet: Parabens are extensively employed as antimicrobial preservatives in cosmetics, personal care items, and pharmaceuticals.. However, their potential metabolism regulating effects, particularly regarding the inhibition of human 11β-hydroxysteroid dehydrogenase type 1 (11β-HSD1), remains unknown.. This study assessed 4-hydroxybenzoic acid and 9 parabens for their ability to inhibit human and rat liver 11β-HSD1, investigating their mechanism of action, structure-activity relationship (SAR), molecular interactions (via in silico docking), and influence on cortisol metabolism in LX-2 cells. Article Title: Species-specific inhibition of human and rat aromatase by mycotoxins: Integrated enzyme assays, docking, and structure-activity relationship analysis. Article Snippet: In placental tissue, human and rat aromatases convert testosterone to estradiol, which was prioritized for investigation over others due to its susceptibility to endocrine disruption by mycotoxins, yet their effects remain unclear.. The objective of this study is to investigate the effects of mycotoxins on human and rat aromatase, including inhibition strength, mechanism, and structural-activity relationships (SAR).. Screening was conducted to evaluate mycotoxin inhibition using placental microsomes by HPLC-MS/MS. Binding Assay:Article Title: PFHxS is predicted to bind KEAP1 and is associated with NRF2-NQO1 activation in hepatocellular carcinoma. Article Snippet: Perfluorohexanesulfonic acid (PFHxS), a prevalent short-chain perand polyfluoroalkyl substance, has been implicated in hepatocellular carcinoma (HCC), but mechanisms remain unclear.. We integrated transcriptomic analyses of The Cancer Genome Atlas (TCGA) liver cancer cohort and an HCC single-cell dataset with molecular docking and molecular dynamics simulations and in vitro assays to examine a PFHxS-relevant hypothesis involving KEAP1–NRF2 signaling.. Across clinical datasets, higher NQO1, an NRF2-associated gene, was linked to adverse clinicopathologic features; NQO1-high tumor cells showed elevated NRF2-activity signatures and computationally inferred increased MIF signaling toward macrophages. Construct:Article Title: Significant enhancement of inhibitory strength of bisphenol A analogs against human and rat 5α-reductase 1 upon halogenation of the benzene ring: Potentially disrupting neurosteroid biosynthesis. Article Snippet: Bisphenol A (BPA) halogenation derivatives, formed via radical or electrophilic substitution, constitute a class of emerging contaminants, with brominated variants dominating the flame-retardant market.. Their effect on steroid 5α-reductase 1 (SRD5A1) activity in neural and testicular cells remains unclear.. This study examined inhibitory effects of seven BPA analogs on SRD5A1, focusing on dihydrotestosterone synthesis. |