Virtual screening of natural products against 5-enolpyruvylshikimate-3-phosphate synthase using the Anagreen herbicide-like natural compound library
Maycon Vinicius Damasceno de Oliveira, Gilson Mateus Bittencourt Fernandes, Kauê Santana da Costa, Serhii Vakal, Anderson H. Lima
Abstract
Identifying new potential herbicides from natural products and describing their interactions with a double EPSP synthase mutant.
Topics & Concepts
PharmacophoreVirtual screeningChemistryNatural productDocking (animal)Ligand (biochemistry)Lead compoundStereochemistryDrug discoveryAvermectinComputational biologyCombinatorial chemistryBiochemistryBiologyReceptorNursingAnatomyMedicineIn vitroWeed Control and Herbicide ApplicationsFungal Plant Pathogen ControlPesticide and Herbicide Environmental Studies