Molecular electrostatic potential, HOMO-LUMO and vibrational study of aristolochic acid II using density functional theory

Because of their wide applications in human or animal medicine, the natural products have been the subject of investigation. Aristolochic acids (AAs) (Aristolochiaceae), however toxic, are reported for many medicinal uses. In this work, computational study on the molecular properties of AA II is pr...

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Hlavní autoři:	Jang Bahadur Khadka, Bhawani Datt Joshi
Médium:	Artigo
Jazyk:	Inglês
Vydáno:	Department of Physics, Mahendra Morang Adarsh Multiple Campus, Tribhuvan University 2014-12-01
Edice:	Bibechana
Témata:	MEP HOMO-LUMO vibrational spectroscopy DFT.
On-line přístup:	https://nepjol.info/index.php/BIBECHANA/article/view/11702
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