QTAIM and NCI analysis of intermolecular interactions in steroid ligands binding a cytochrome P450 enzyme – Beyond the most obvious interactions
The 17a-hydroxylase-17,20-lyase (CYP17) is a cytochrome P450 enzyme which participates in steroid hormones metabolism. Pregnenolone (PREG) is its natural steroid substrate and abiraterone (ABE) is a well-known steroid inhibitor. In this paper, QTAIM and NCI analysis indicate many non-familiar in...
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| Principais autores: | , , |
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| Formato: | article |
| Idioma: | English |
| Publicado em: |
Computational And Theoretical Chemistry
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| Endereço do item: | https://repositorio.ufrn.br/handle/123456789/31555 |
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