Publication | Open Access

Computational identification of 2,4-disubstituted amino-pyrimidines as L858R/T790M-EGFR double mutant inhibitors using pharmacophore mapping, molecular docking, binding free energy calculation, DFT study and molecular dynamic simulation

Medicinal ChemistryDrug TargetBiochemistryMedicineNatural SciencesPharmacologyRational Drug DesignFree Energy CalculationComputational IdentificationDrug DevelopmentMolecular DockingDrug Discovery