Insilico design, ADMET screening, MM-GBSA binding free energy of novel 1,3,4 oxadiazoles linked Schiff bases as PARP-1 inhibitors targeting breast cancer

• Hoofdauteurs: Narayan Shridhar Deshpande (Auteur), Gowdru Srinivasa Mahendra (Auteur), Natasha Naval Aggarwal (Auteur), Banylla Felicity Dkhar Gatphoh (Auteur), Bistuvalli Chandrashekharappa Revanasiddappa (Auteur)
• Formaat: Boek
• Gepubliceerd in: SpringerOpen, 2021-08-01T00:00:00Z.
• Onderwerpen: article
• Online toegang: Connect to this object online.

Abstract Background Poly(ADP-ribose) polymerases (PARPs), a nuclear protein belongs to a new class of drugs, which mainly target tumours with DNA repair defects. They are mainly involved in the multiple cellular processes in addition to the DNA repair process. They act directly on the base excision...