The integration of molecular docking techniques into the design and evaluation of novel antimicrobial agents has rapidly transformed drug discovery. This approach involves using advanced computational ...
Ligand Pro, founded by Skoltech professors and a Skoltech Ph.D. student, has presented Matcha, an AI-powered molecular docking model that performs virtual drug screening 30 times faster than the large ...
A study published in the Journal of Bioresources and Bioproducts establishes quantitative structure-activity relationships governing surfactant efficacy against phenolic inhibition in lignocellulose ...
(a–c) The 3D visualization of molecular docking modes of HXTL’s top four active components (luteolin, beta-sitosterol, stigmasterol, quercetin) and top three HXTL-PMOP targets (IL6, AKT1, PI3K). (d) ...
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