Detalhe da pesquisa
1.
Integrated virtual screening, molecular modeling and machine learning approaches revealed potential natural inhibitors for epilepsy.
Saudi Pharm J
; 31(12): 101835, 2023 Dec.
Artigo
em Inglês
| MEDLINE | ID: mdl-37965486
2.
Integrated virtual screening and molecular dynamics simulation approaches revealed potential natural inhibitors for DNMT1 as therapeutic solution for triple negative breast cancer.
J Biomol Struct Dyn
; 42(3): 1099-1109, 2024.
Artigo
em Inglês
| MEDLINE | ID: mdl-37021492
3.
Structural insights into the mechanism of resistance to bicalutamide by the clinical mutations in androgen receptor in chemo-treatment resistant prostate cancer.
J Biomol Struct Dyn
; 42(3): 1181-1190, 2024.
Artigo
em Inglês
| MEDLINE | ID: mdl-37144757
4.
Structural and energetic analysis of NS5 protein inhibition by small molecules in Japanese encephalitis virus using machine learning and steered molecular dynamics approach.
J Biomol Struct Dyn
; : 1-18, 2024 Feb 26.
Artigo
em Inglês
| MEDLINE | ID: mdl-38407246
5.
In silico assessment of a natural small molecule as an inhibitor of programmed death ligand 1 for cancer immunotherapy: a computational approach.
J Biomol Struct Dyn
; : 1-21, 2024 Feb 22.
Artigo
em Inglês
| MEDLINE | ID: mdl-38385444
6.
Understanding the prevalence, progression, and management of metabolic syndrome in Saudi Arabia.
Saudi Med J
; 44(10): 973-986, 2023 Oct.
Artigo
em Inglês
| MEDLINE | ID: mdl-37777274
7.
Network pharmacology-based screening of active constituents of Avicennia marina and their clinical biochemistry related mechanism against breast cancer.
J Biomol Struct Dyn
; : 1-16, 2023 Jun 12.
Artigo
em Inglês
| MEDLINE | ID: mdl-37306420
8.
Integrated molecular modeling and dynamics approaches revealed potential natural inhibitors of NF-κB transcription factor as breast cancer therapeutics.
J Biomol Struct Dyn
; 41(24): 14715-14729, 2023.
Artigo
em Inglês
| MEDLINE | ID: mdl-37301608