Results 241 to 250 of about 382,305 (392)

Accurate and Rapid Ranking of Protein–Ligand Binding Affinities Using Density Matrix Fragmentation and Physics‐Informed Machine Learning Dispersion Potentials

open access: yesChemPhysChem, EarlyView.
Two efficient methods, generalized many‐body expansion for building density matrices (GMBE‐DM) and D3‐ML, are introduced for ranking protein–ligand binding affinities. GMBE‐DM delivers quantum‐accurate results within minutes, while D3‐ML achieves even higher accuracy in under one second per complex.
Ka Un Lao, Danyang Wang
wiley   +1 more source

Targeting Mediator Kinase Cyclin-Dependent Kinases 8/19 Potentiates Chemotherapeutic Responses, Reverses Tumor Growth, and Prolongs Survival from Ovarian Clear Cell Carcinoma. [PDF]

open access: yesCancers (Basel)
Barton WC   +9 more
europepmc   +1 more source

Bioinformatics analysis of immune‐programmed cell death‐related genes in nasopharyngeal carcinoma

open access: yesEye &ENT Research, EarlyView.
Abstract Background Nasopharyngeal carcinoma (NPC) is a prevalent malignant tumor of the head and neck, characterized by a complex pathogenesis. Most newly diagnosed NPC patients are locally advanced, and 20%–30% of advanced NPC patients have poor immunotherapy results.
Hongqiang Chen   +3 more
wiley   +1 more source

Phosphorylation of mixed lineage kinase MLK3 by cyclin-dependent kinases CDK1 and CDK2 controls ovarian cancer cell division. [PDF]

open access: yesJ Biol Chem, 2022
Cedeno-Rosario L   +5 more
europepmc   +1 more source

DMAPO/Boc2O‐Mediated One‐Pot Direct N‐Acylation of Sulfoximines with Carboxylic Acids

open access: yesEuropean Journal of Organic Chemistry, Accepted Article.
This report describes a general and simple method for the one‐pot direct N‐acylation of sulfoximines with carboxylic acids using our previously developed 4‐(N,N‐dimethylamino)pyridine N‐oxide (DMAPO)/di‐tert‐butyl dicarbonate (Boc2O) system. The method can be performed under mild low‐temperature reaction conditions and has a wide substrate scope.
Atsushi Umehara   +2 more
wiley   +1 more source

Home - About - Disclaimer - Privacy