DFT, MM and ADMET integrated computations on a naturally occurring biomolecule (Luteolin-7-O-β-D-glucoside) and its interaction with various protein-receptors reveal its phase-dependent nonlinear optical and multifunctional drug activity

  • Ryan John Laverne
  • , Anjali Sharma
  • , Abha
  • , Aman Tiwari
  • , Sudheesh K. Shukla
  • , Penny P. Govender
  • , Ashok Kumar Mishra

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Chemistry