Developing a Naïve Bayesian Classification Model with PI3Kγ structural features for virtual screening against PI3Kγ: Combining molecular docking and pharmacophore based on multiple PI3Kγ conformations
Yingmin Jiang, Wendian Xiong, Lei Jia, Lei Xu, Yanfei Cai, Yun Chen, Jian Jin, Mingzhu Gao, Jingyu Zhu
Topics & Concepts
PharmacophoreVirtual screeningDocking (animal)Computational biologyPI3K/AKT/mTOR pathwayChemistrySmall moleculeDOCKCombinatorial chemistryStereochemistryBiochemistryBiologySignal transductionMedicineNursingCytokine Signaling Pathways and InteractionsComputational Drug Discovery MethodsPI3K/AKT/mTOR signaling in cancer