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What is DFT Molecular Docking and Molecular Dynamics Simulation Studies On Some Recent Natural Products Revealing Their EGFR Tyrosine Kinase Inhibition Poten about?

This study investigates the potential of fourteen recent triterpenoid natural products as EGFR tyrosine kinase inhibitors using computational techniques such as DFT calculations, molecular docking, and molecular dynamics simulations. The results indicate that many of these compounds exhibit promising inhibitory effects compared to the reference drug Gefitinib. The findings contribute to the development of new EGFR inhibitors in cancer treatment research.

Author

Prabuddha

Language

EN