Identification of novel CDK 9 inhibitors based on virtual screening, molecular dynamics simulation, and biological evaluation
Mingfei Wu, Jianfei Han, Zhicheng Liu, Yilong Zhang, Cheng Zhi Huang, Jun Li, Li Zeng
Topics & Concepts
Virtual screeningIdentification (biology)Computational biologyMolecular dynamicsChemistryComputer scienceBiologyComputational chemistryEcologyCancer-related Molecular PathwaysAdvanced Breast Cancer TherapiesComputational Drug Discovery Methods