Optimization of virtual screening against phosphoinositide 3-kinase delta: Integration of common feature pharmacophore and multicomplex-based molecular docking.
Jingyu ZhuHuiqin MengXintong LiLei JiaLei XuYanfei CaiYun ChenJian JinLi YuPublished in: Comput. Biol. Chem. (2024)
Keyphrases
- drug discovery
- virtual screening
- binding sites
- chemical structures
- sequence alignment
- similarity searching
- early stage
- chemical compounds
- gene expression
- high throughput
- data mining
- biological data
- sequence data
- biological systems
- data mining tools
- scientific data
- dna sequences
- bayesian networks
- systems biology
- discovery process
- knowledge discovery
- databases