Molecular Screening of High-Energy Nitrocompounds | Sciact - научная деятельность

Molecular Screening of High-Energy Nitrocompounds Научная публикация

Журнал

Mendeleev Communications
ISSN: 1364-551X , E-ISSN: 0959-9436

Вых. Данные

Год: 1991, Том: 1, Номер: 4, Страницы: 122-124 Страниц : 3 DOI: 10.1070/mc1991v001n04abeh000075

Авторы

Pivina Tatyana S. ¹ , Shlyapochnikov Vladimir A. ¹ , Molchanova Marina S. ¹ , Agranov Gennadiy Kh. ² , Rukin Vladimir L. ²

Организации

1	N.D. Zelinsky Institute of Organic Chemistry, Academy of Sciences of the USSR, 117913 Moscow, USSR
2	Lensoviet Technology Institute, 198013 Leningrad, USSR

An effective method for the molecular screening of compounds within a particular range of formation enthalpies has been developed; this approach is identical to the classification problem and is handled by the method of logical correlations, the inclusion of a substance in a given range of enthalpies being determined by the presence of informative local features in the structural topology of the compound; the high predictive ability of the method is demonstrated by the screening of high-energy nitrocompounds.

Pivina T.S. , Shlyapochnikov V.A. , Molchanova M.S. , Agranov G.K. , Rukin V.L.
Molecular Screening of High-Energy Nitrocompounds
Mendeleev Communications. 1991. V.1. N4. P.122-124. DOI: 10.1070/mc1991v001n04abeh000075 Scopus OpenAlex

Scopus:	2-s2.0-85018772799
OpenAlex:	W2075807438

БД	Цитирований
OpenAlex	5
Scopus	3