Computer prediction of biological activity of 1,2,4-triazole derivatives of 1,4 naphthoquinone
Computer simulation in the chemical technology and engineering
3rd International Scientific Conference «Chemical Technology and Engineering»: Proceedings – June 21–24th, 2021, Lviv, Ukraine – Lviv: Lviv Polytechnic National University, 2021, pp. 32–34
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First published on this website: 24.03.2021 - 20:59
Abstract
Promising directions of experimental research of 1,2,4-triazole-containing 1,4‑naphthoquinone derivatives biological activity using preliminary computer prediction with the PASS Online and GUSAR programs were found.
Keywords
References
- Polish, N.V., Marintsova, N.G., Karkhut, A.I.,.Kovalenko, S.I., Novikov, V.P. (2020). Synthesis of new 1,2,4-triazine- And 1,2,4-triazole-containing 1,4-naphthoquinone derivatives and the study of their biological activity. Voprosy Khimii i Khimicheskoi Tekhnologii, no. 5, pp. 73-80. https://doi.org/10.32434/0321-4095-2020-132-5-73-80
- Filimonov, D. A., Lagunin, A. A., Gloriozova, T. A., Rudik, A. V., Druzhilovskii, D. S., Pogodin, P. V., & Poroikov, V. V. Prediction of the biological activity spectra of organic compounds using the PASS online web resource. Chemistry of Heterocyclic Compounds, 2014, vol. 50, no. 3, pp. 444-457. https://doi.org/10.1007/s10593-014-1496-1
- Lagunin, A., Zakharov, A., Filimonov, D., & Poroikov, V. QSAR modelling of rat acute toxicity on the basis of PASS prediction. Molecular informatics, 2011, vol. 30, no.(2‐3), pp. 241-250. https://doi.org/10.1002/minf.201000151
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Dear authors,
Please format all the literature on the references list according to APA style: https://www.mtroyal.ca/library/files/citation/apa.pdf
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Шановний Олександр Сергійович!
Літературу відформатовано згідно стилю АРА.
З повагою, Наталія Поліш