183 related articles for article (PubMed ID: 36165610)
1. Flavonoids as promising anticancer agents: an
Biharee A; Yadav A; Jangid K; Singh Y; Kulkarni S; Sawant DM; Kumar P; Thareja S; Jain AK
J Biomol Struct Dyn; 2023; 41(16):7835-7846. PubMed ID: 36165610
[TBL] [Abstract][Full Text] [Related]
2. Investigating a Library of Flavonoids as Potential Inhibitors of a Cancer Therapeutic Target MEK2 Using in Silico Methods.
AlZahrani WM; AlGhamdi SA; Sohrab SS; Rehan M
Int J Mol Sci; 2023 Feb; 24(5):. PubMed ID: 36901876
[TBL] [Abstract][Full Text] [Related]
3. Molecular docking and dynamics simulation study of quinones and pyrones from
H N K; Murali Sharma P; Garampalli RH
J Biomol Struct Dyn; 2023; 41(24):14744-14756. PubMed ID: 36935093
[TBL] [Abstract][Full Text] [Related]
4. Molecular Docking and Dynamic Simulation to Identify α7nAChR Binding Affinity of Flavonoids for the Treatment of Alzheimer's Disease.
Singh S; Goyal A; Agrawal N
Chem Biodivers; 2023 Jul; 20(7):e202300306. PubMed ID: 37249245
[TBL] [Abstract][Full Text] [Related]
5. Identification of 1,3,4-oxadiazoles as tubulin-targeted anticancer agents: a combined field-based 3D-QSAR, pharmacophore model-based virtual screening, molecular docking, molecular dynamics simulation, and density functional theory calculation approach.
Das A; Sarangi M; Jangid K; Kumar V; Kumar A; Singh PP; Kaur K; Kumar V; Chakraborty S; Jaitak V
J Biomol Struct Dyn; 2023 Sep; ():1-19. PubMed ID: 37695635
[TBL] [Abstract][Full Text] [Related]
6. Investigation of the New Inhibitors by Sulfadiazine and Modified Derivatives of α-D-glucopyranoside for White Spot Syndrome Virus Disease of Shrimp by In Silico: Quantum Calculations, Molecular Docking, ADMET and Molecular Dynamics Study.
Kumer A; Chakma U; Rana MM; Chandro A; Akash S; Elseehy MM; Albogami S; El-Shehawi AM
Molecules; 2022 Jun; 27(12):. PubMed ID: 35744817
[TBL] [Abstract][Full Text] [Related]
7. Design of novel isoxazole derivatives as tubulin inhibitors using computer-aided techniques: QSAR modeling,
Moukhliss Y; Koubi Y; Zafar I; Alaqarbeh M; Maghat H; Sbai A; Lakhlifi T; Bouachrine M
J Biomol Struct Dyn; 2024 Feb; ():1-12. PubMed ID: 38353497
[TBL] [Abstract][Full Text] [Related]
8. A novel imidazole-based azo molecule: synthesis, characterization, quantum chemical calculations, molecular docking, molecular dynamics simulations and ADMET properties.
Karabacak Atay Ç; Dilek Ö; Tilki T; Dede B
J Mol Model; 2023 Jul; 29(8):226. PubMed ID: 37405575
[TBL] [Abstract][Full Text] [Related]
9. Synthesis, biological profile and computational insights of new derivatives of benzo [B][1,4] diazepines as prospective anticancer agents for inhibiting the CDK-2 protein.
Dar PA; Bhat BA; Mir MA; Chaudhari SY; Shah WA
J Biomol Struct Dyn; 2024 Feb; ():1-16. PubMed ID: 38344942
[TBL] [Abstract][Full Text] [Related]
10. Exploring the Natural Compounds in Flavonoids for Their Potential Inhibition of Cancer Therapeutic Target MEK1 Using Computational Methods.
AlZahrani WM; AlGhamdi SA; Zughaibi TA; Rehan M
Pharmaceuticals (Basel); 2022 Feb; 15(2):. PubMed ID: 35215307
[TBL] [Abstract][Full Text] [Related]
11. Multitargeted molecular docking and dynamics simulation studies of flavonoids and volatile components from the peel of
Rajiv Gandhi G; Sharanya CS; Jayanandan A; Haridas M; Edwin Hillary V; Rajiv Gandhi S; Sridharan G; Sivasubramanian R; Silva Vasconcelos AB; Montalvão MM; Antony Ceasar S; Sousa NF; Scotti L; Scotti MT; Gurgel RQ; Quintans-Júnior LJ
J Biomol Struct Dyn; 2024 Apr; 42(6):3051-3080. PubMed ID: 37203996
[No Abstract] [Full Text] [Related]
12. Design, synthesis, and bioevaluation of novel unsaturated cyanoacetamide derivatives: In vitro and in silico exploration.
Uddin KM; Meem MH; Akter M; Rahman S; Al-Gawati MA; Alarifi N; Albrithen H; Alodhayb A; Poirier RA; Bhuiyan MMH
MethodsX; 2024 Jun; 12():102691. PubMed ID: 38660042
[TBL] [Abstract][Full Text] [Related]
13. Molecular docking, molecular dynamics simulation, and MM/PBSA analysis of ginger phytocompounds as a potential inhibitor of AcrB for treating multidrug-resistant
Sahoo M; Behera DU; Gaur M; Subudhi E
J Biomol Struct Dyn; 2024 Jan; ():1-17. PubMed ID: 38165647
[TBL] [Abstract][Full Text] [Related]
14. Novel computational and drug design strategies for inhibition of human papillomavirus-associated cervical cancer and DNA polymerase theta receptor by Apigenin derivatives.
Akash S; Bayıl I; Hossain MS; Islam MR; Hosen ME; Mekonnen AB; Nafidi HA; Bin Jardan YA; Bourhia M; Bin Emran T
Sci Rep; 2023 Oct; 13(1):16565. PubMed ID: 37783745
[TBL] [Abstract][Full Text] [Related]
15. Assessment of iridoids and their similar structures as antineoplastic drugs by
Neupane P; Adhikari Subin J; Adhikari R
J Biomol Struct Dyn; 2024 Feb; ():1-16. PubMed ID: 38345021
[TBL] [Abstract][Full Text] [Related]
16. Flavonoids as potential KRAS inhibitors: DFT, molecular docking, molecular dynamics simulation and ADMET analyses.
Prinsa ; Saha S; Bulbul MZH; Ozeki Y; Alamri MA; Kawsar SMA
J Asian Nat Prod Res; 2024 Apr; ():1-38. PubMed ID: 38647682
[TBL] [Abstract][Full Text] [Related]
17. In silico design based on quantum chemical, molecular docking studies and ADMET predictions of ciprofloxacin derivatives as novel potential antibacterial and antimycrobacterium agents.
Benselama W; Benchouk W
J Biomol Struct Dyn; 2023 Aug; ():1-17. PubMed ID: 37551116
[TBL] [Abstract][Full Text] [Related]
18. Phytochemicals as potential inhibitors of interleukin-8 for anticancer therapy:
Alshahrani MY; Alkhathami AG; Almoyad MAA; Ahmad MZ; Mohanto S; Ahmad W; Wahab S
J Biomol Struct Dyn; 2023 Dec; ():1-12. PubMed ID: 38116764
[TBL] [Abstract][Full Text] [Related]
19. Exploring the effectiveness of flavone derivatives for treating liver diseases: Utilizing DFT, molecular docking, and molecular dynamics techniques.
Quayum ST; Esha NJI; Siraji S; Abbad SSA; Alsunaidi ZHA; Almatarneh MH; Rahman S; Alodhayb AN; Alibrahim KA; Kawsar SMA; Uddin KM
MethodsX; 2024 Jun; 12():102537. PubMed ID: 38299040
[TBL] [Abstract][Full Text] [Related]
20. Identification of potential drug candidates as TGR5 agonist to combat type II diabetes using
Bhimanwar RS; Lokhande KB; Shrivastava A; Singh A; Chitlange SS; Mittal A
J Biomol Struct Dyn; 2023; 41(22):13314-13331. PubMed ID: 36724473
[TBL] [Abstract][Full Text] [Related]
[Next] [New Search]
