Ads
related to: high throughput virtual screening system
Search results
Results from the WOW.Com Content Network
High-throughput screening (HTS) is a method for scientific discovery especially used in drug discovery and relevant to the fields of biology, materials science [1] and chemistry. [ 2 ] [ 3 ] Using robotics , data processing/control software, liquid handling devices, and sensitive detectors, high-throughput screening allows a researcher to ...
Therefore, the process of finding new drugs usually involves high-throughput screening (HTS). HTS enables the rapid identification of active compounds. [ 9 ] For example, virtual screening can be used as an early stage of the drug discovery pipeline to evaluate the interactions between large datasets of small molecules and a drug target ...
Virtual screening (VS) is a computational technique used in drug discovery to search libraries of small molecules in order to identify those structures which are most likely to bind to a drug target, typically a protein receptor or enzyme. [2] [3] Virtual screening has been defined as "automatically evaluating very large libraries of compounds ...
The number of notable protein-ligand docking programs currently available is high and has been steadily increasing over the last decades. The following list presents an overview of the most common notable programs, listed alphabetically, with indication of the corresponding year of publication, involved organisation or institution, short description, availability of a webservice and the license.
Operating system: Linux: Type: ... It is primarily designed for high-throughput virtual screening and prediction of binding mode. ... Virtual screening;
Protein–protein interaction screening refers to the identification of Protein–protein interaction with high-throughput screening methods such as computer- and/or robot-assisted plate reading, flow cytometry analyzing. The interactions between proteins are central to virtually every process in a living cell.
According to a review from 2017, LeDock was noted for its effectiveness in sampling ligand conformational space, identifying near-native binding poses, and having a flexible docking protocol. The Linux version includes tools for high-throughput virtual screening in the cloud.
Types of drug screening include phenotypic screening, high-throughput screening, and virtual screening. Phenotypic screening is characterized by the process of screening drugs using cellular or animal disease models to identify compounds that alter the phenotype and produce beneficial disease-related effects.
Ads
related to: high throughput virtual screening system