Results 1 to 10 of about 1,236,846 (314)

A perspective on the discovery of enzyme activators

open access: yesSLAS Discovery, 2022
Enzyme activation remains a largely under-represented and poorly exploited area of drug discovery despite some key literature examples of the successful application of enzyme activators by various mechanisms and their importance in a wide range of ...
Antonia Turberville   +4 more
doaj   +1 more source

High throughput screening of 0.5 million compounds against CRAF using Alpha CETSAⓇ

open access: yesSLAS Discovery, 2023
The cellular thermal shift assay (CETSA®) has increasingly been used in early drug discovery to provide a measure of cellular target engagement. Traditionally, CETSA has been employed for bespoke questions with small to medium throughput and has ...
Hannah Rowlands   +9 more
doaj   +1 more source

A Novel Approach To Identify Inhibitors of Iron Acquisition Systems of Pseudomonas aeruginosa

open access: yesMicrobiology Spectrum, 2022
Pseudomonas aeruginosa is an opportunistic pathogen that has been declared by the World Health Organization as a “priority 1 critical pathogen” needing immediate new strategies for chemotherapy. During infection, P.
Mamie Kannon   +5 more
doaj   +1 more source

EndoBind detects endogenous protein-protein interactions in real time

open access: yesCommunications Biology, 2021
Bill et al describe two high-throughput methods to detect protein-protein interactions in cells in real-time using the split-NanoLuciferase-complementation system.
Anke Bill   +12 more
doaj   +1 more source

High-throughput screening of 2D van der Waals crystals with plastic deformability

open access: yesNature Communications, 2022
Inorganic semiconductors exhibit multifarious physical properties, but they are prevailingly brittle, impeding their application in flexible and hetero-shaped electronics.
Zhiqian Gao   +7 more
semanticscholar   +1 more source

Utilising acoustic mist ionisation mass spectrometry to identify redox cycling compounds in high throughput screening outputs

open access: yesSLAS Discovery, 2022
Rapid triage of compounds acting via undesired mechanisms is a crucial stage in a high-throughput screening (HTS) cascade to ensure time and resource is efficiently assigned to the most propitious hits.
Rachel Moore   +4 more
doaj   +1 more source

Computational Discovery of Transition-metal Complexes: From High-throughput Screening to Machine Learning.

open access: yesChemical Reviews, 2021
Transition-metal complexes are attractive targets for the design of catalysts and functional materials. The behavior of the metal-organic bond, while very tunable for achieving target properties, is challenging to predict and necessitates searching a ...
Aditya Nandy   +5 more
semanticscholar   +1 more source

High-Throughput Screening Platforms in the Discovery of Novel Drugs for Neurodegenerative Diseases

open access: yesBioengineering, 2021
Neurodegenerative diseases (NDDs) are incurable and debilitating conditions that result in progressive degeneration and/or death of nerve cells in the central nervous system (CNS).
H. Aldewachi   +3 more
semanticscholar   +1 more source

High-throughput detection of metal contamination in HTS outputs

open access: yesSLAS Discovery, 2022
Large compound libraries utilised for HTS often include metal contaminated compounds which can interfere with assay signal or target biology, and therefore appear as hits.
Corinne Molyneux   +5 more
doaj   +1 more source

Molecular docking-based computational platform for high-throughput virtual screening

open access: yesCCF Transactions on High Performance Computing, 2022
Structure-based virtual screening is a key, routine computational method in computer-aided drug design. Such screening can be used to identify potentially highly active compounds, to speed up the progress of novel drug design.
Baohua Zhang   +3 more
semanticscholar   +1 more source

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