Identification of a novel dual-target scaffold for 3CLpro and RdRp proteins of SARS-CoV-2 using 3D-similarity search, molecular docking, molecular dynamics and ADMET evaluation

Benzer Materyaller

• Computer aided drug design based on 3D-QSAR and molecular docking studies of 5-(1H-indol-5-yl)-1,3,4-thiadiazol-2-amine derivatives as PIM2 inhibitors: a proposal to chemists
  Yazar:: Aouidate, Adnane, ve diğerleri
  Baskı/Yayın Bilgisi: (2018)
• QSAR study and rustic ligand-based virtual screening in a search for aminooxadiazole derivatives as PIM1 inhibitors
  Yazar:: Aouidate, Adnane, ve diğerleri
  Baskı/Yayın Bilgisi: (2018)
• QSAR studies on PIM1 and PIM2 inhibitors using statistical methods: a rustic strategy to screen for 5-(1H-indol-5-yl)-1,3,4-thiadiazol analogues and predict their PIM inhibitory activity
  Yazar:: Aouidate, Adnane, ve diğerleri
  Baskı/Yayın Bilgisi: (2017)
• In Silico Exploration of Aryl Halides Analogues as Checkpoint Kinase 1 Inhibitors by Using 3D QSAR, Molecular Docking Study, and ADMET Screening
  Yazar:: Ghaleb, Adib, ve diğerleri
  Baskı/Yayın Bilgisi: (2019)
• Prediction of potential inhibitors of SARS-CoV-2 using 3D-QSAR, molecular docking modeling and ADMET properties
  Yazar:: Khaldan, Ayoub, ve diğerleri
  Baskı/Yayın Bilgisi: (2021)