DFT Conformational, Wavefunction Based Reactivity Analysis, Docking and MD Simulations of a Carboxamide Derivative with Potential Anticancer Activity

Journal article

Peer reviewed

Jamelah S. Al-Otaibi, Y. Sheena Mary, Y. Shyma Mary and S. Aayisha

Polycyclic aromatic compounds, Vol.43(2), pp.1590-1601

07/02/2023

Metrics

1 Record Views

Title: DFT Conformational, Wavefunction Based Reactivity Analysis, Docking and MD Simulations of a Carboxamide Derivative with Potential Anticancer Activity
Creators - without role: Jamelah S. Al-Otaibi - Princess Nourah bint Abdulrahman University
Y. Sheena Mary - Thushara, Kollam, India
Y. Shyma Mary - Thushara, Kollam, India
S. Aayisha - Meenakshi Academy of Higher Education and Research
Publication Details: Polycyclic aromatic compounds, Vol.43(2), pp.1590-1601
Identifiers: 9927725708331
Academic Unit: Princess Nourah bint Abdulrahman University
Language: English
Resource Type: Journal article