Computer-aided anti-cancer drug discovery of EGFR protein based on virtual screening of drug bank, ADMET, docking, DFT and molecular dynamic simulation studies

Computer-aided anti-cancer drug discovery of EGFR protein based on virtual screening of drug bank, ADMET, docking, DFT and molecular dynamic simulation studies

Numerous malignancies, including breast cancer, non-small cell lung cancer, and chronic myeloid leukemia, are brought on by aberrant tyrosine kinase signaling. Since the current chemotherapeutic medicines are toxic, there is a great need and demand from cancer patients to find novel chemicals that a...

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Bibliographic Details
Main Authors: Roney, Miah, Dubey, Amit, Muhammad Hassan, Nasir, Tufail, Aisha, Saiful Nizam, Tajuddin, Mohd Fadhlizil Fasihi, Mohd Aluwi, Huq, A. K. M. Moyeenul
Format: Article
Language:English
English
Published: Taylor & Francis 2023
Subjects:
HD Industries. Land use. Labor
R Medicine (General)
Online Access:http://umpir.ump.edu.my/id/eprint/41756/
http://umpir.ump.edu.my/id/eprint/41756/1/Computer-aided%20anti-cancer%20drug%20discovery%20of%20EGFR%20protein%20based%20on%20virtual%20screening%20of%20drug%20bank%2C%20ADMET%2C%20docking%2C%20DFT.pdf
http://umpir.ump.edu.my/id/eprint/41756/2/Computer-aided%20anti-cancer%20drug%20discovery%20of%20EGFR%20protein%20based%20on%20virtual%20screening%20of%20drug%20bank%2C%20ADMET%2C%20docking%2C%20DFT%20and%20molecular%20dynamic%20simulation%20studies.pdf

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