Litcius/Paper detail

Discovery of novel dual acetylcholinesterase and butyrylcholinesterase inhibitors using machine learning and structure-based drug design

Manish Tripathi, Bhagwati Bhardwaj, Digambar Kumar Waiker, Avanish Tripathi, Sushant K. Shrivastava

2023Journal of Molecular Structure24 citationsDOI

Topics & Concepts

AcetylcholinesteraseButyrylcholinesteraseChemistryIn silicoCholinesteraseAchéAcetylcholineIC50Virtual screeningDocking (animal)PharmacologyBiochemistryStereochemistryEnzymeDrug discoveryIn vitroBiologyGeneNursingMedicineComputational Drug Discovery MethodsCholinesterase and Neurodegenerative DiseasesMedicinal Plants and Neuroprotection