Perspectives on current approaches to virtual screening in drug discovery
Introduction For the past two decades, virtual screening (VS) has been an efficient hit finding
approach for drug discovery. Today, billions of commercially accessible compounds are …
approach for drug discovery. Today, billions of commercially accessible compounds are …
Novel 2-substituted-quinoxaline analogs with potential antiproliferative activity against breast cancer: insights into cell cycle arrest, topoisomerase II, and EGFR activity
MG Salem, SAA El-Ata, EH Elsayed, SN Mali… - RSC …, 2023 - pubs.rsc.org
Breast cancer is a global health concern, with increasing disease burden and disparities in
access to healthcare. Late diagnosis and limited treatment options in underserved areas …
access to healthcare. Late diagnosis and limited treatment options in underserved areas …
Deep generative models in the quest for anticancer drugs: ways forward
Drug discovery is a costly and time-consuming process, especially because of the significant
expenses connected with the high percentage of clinical trial failures. As such, there is a …
expenses connected with the high percentage of clinical trial failures. As such, there is a …
A hybrid energy-based and AI-based screening approach for the discovery of novel inhibitors of JAK3
J Wei, Y Pan, Z Shen, L Shen, L Xu, W Yu… - Frontiers in …, 2023 - frontiersin.org
The JAKs protein family is composed of four isoforms, and JAK3 has been regarded as a
druggable target for the development of drugs to treat various diseases, including …
druggable target for the development of drugs to treat various diseases, including …
Molecular docking study of frequently used food additives for selected targets depending on the chromosomal abnormalities they cause
F Okus, D Yuzbasioglu, F Unal - Toxicology, 2024 - Elsevier
Food additives (FAs)(flavor enhancers, sweeteners, etc.) protect foods during storage and
transportation, making them attractive to consumers. Today, while the desire to access …
transportation, making them attractive to consumers. Today, while the desire to access …