Interactions of 2-phenyl-benzotriazole xenobiotic compounds with human Cytochrome P450-CYP1A1 by means of docking, molecular dynamics simulations and MM-GBSA calculations
Keywords: molecular docking, mm-gbsa, molecular dynamics simulations, 2-Phenyl-benzotriazole
Más información
| Título según WOS: | Interactions of 2-phenyl-benzotriazole xenobiotic compounds with human Cytochrome P450-CYP1A1 by means of docking, molecular dynamics simulations and MM-GBSA calculations |
| Título según SCOPUS: | Interactions of 2-phenyl-benzotriazole xenobiotic compounds with human Cytochrome P450-CYP1A1 by means of docking, molecular dynamics simulations and MM-GBSA calculations |
| Título de la Revista: | COMPUTATIONAL BIOLOGY AND CHEMISTRY |
| Volumen: | 74 |
| Editorial: | ELSEVIER SCI LTD |
| Fecha de publicación: | 2018 |
| Página de inicio: | 253 |
| Página final: | 262 |
| Idioma: | English |
| DOI: |
10.1016/j.compbiolchem.2018.04.004 |
| Notas: | ISI, SCOPUS |