Computational and experimental repositioning of quinoline analogues as KSP inhibitors: insights from free energy landscape and PCA analysis
Shankar G. Alegaon, Shriram D. Ranade, Shankar Gharge, Rohini S. Kavalapure, Venkatasubramanian Ulaganathan
Topics & Concepts
Docking (animal)CytotoxicityChemistryMitosisCancer cellCell cycleMTT assayIC50Cell growthBiochemistryCancer researchCell biologyIn vitroApoptosisCancerBiologyMedicineNursingGeneticsMicrotubule and mitosis dynamicsProtein Degradation and InhibitorsCancer therapeutics and mechanisms