Ahsin A - Search Results

1

Polaron Formation in Conducting Polymers: A Novel Approach to Designing Materials with a Larger NLO Response.

Ahsin A, Ejaz I, Sarfaraz S, Ayub K, Ma H. Ahsin A, et al. ACS Omega. 2024 Mar 18;9(12):14043-14053. doi: 10.1021/acsomega.3c09468. eCollection 2024 Mar 26. ACS Omega. 2024. PMID: 38559943 Free PMC article.

2

Insights into the crystal structure investigation and virtual screening approach of quinoxaline derivatives as potent against c-Jun N-terminal kinases 1.

Mohamed SK, Karthikeyan S, A Omran O, Ahsin A, Salah H, Mague JT, Al-Salahi R, El Bakri Y. Mohamed SK, et al. Among authors: ahsin a. J Biomol Struct Dyn. 2024 Feb 7:1-20. doi: 10.1080/07391102.2024.2305317. Online ahead of print. J Biomol Struct Dyn. 2024. PMID: 38321917

3

XRD/DFT, Hirshfeld surface analysis and molecular modelling simulations for unfolding reactivity of newly synthesized vanillin derivatives: excellent optical, NLO and protein binding efficiency.

Mohamed SK, Ahsin A, Rehman HM, Mohammed HH, Mague JT, Al-Salahi R, El Bakri Y, Hussein BRM. Mohamed SK, et al. Among authors: ahsin a. J Biomol Struct Dyn. 2024 Feb 2:1-19. doi: 10.1080/07391102.2024.2308774. Online ahead of print. J Biomol Struct Dyn. 2024. PMID: 38305762

4

Color properties and non-covalent interactions in hydrated (Z)-4-(1-cyano-2-(2,4,5-trimethoxyphenyl)-vinyl)pyridin-1-ium chloride salt: Insights from experimental and theoretical studies.

Pérez-Gutiérrez E, Ahsin A, El Bakri Y, Venkatesan P, Thamotharan S, Percino MJ. Pérez-Gutiérrez E, et al. Among authors: ahsin a. Heliyon. 2023 Oct 18;9(11):e21040. doi: 10.1016/j.heliyon.2023.e21040. eCollection 2023 Nov. Heliyon. 2023. PMID: 37954267 Free PMC article.

5

Synthesis, structural and X-ray analysis evaluations and computational studies of newly tetrahydroisoquinoline derivatives as potent against microsomal prostaglandin E synthase 1.

Mohamed SK, Karthikeyan S, Khamies E, Ahsin A, Bakhite E, S Marae I, I El-Emary T, Mague JT, I Said A, Al-Salahi R, El Bakri Y. Mohamed SK, et al. Among authors: ahsin a. J Biomol Struct Dyn. 2023 Oct 25:1-15. doi: 10.1080/07391102.2023.2272745. Online ahead of print. J Biomol Struct Dyn. 2023. PMID: 37878040

6

Geometric, Electronic, and Optoelectronic Properties of Carbon-Based Polynuclear C₃O[C(CN)₂]₂M₃ (where M = Li, Na, and K) Clusters: A DFT Study.

Bayach I, Ahsin A, Majid SU, Rashid U, Sheikh NS, Ayub K. Bayach I, et al. Among authors: ahsin a. Molecules. 2023 Feb 15;28(4):1827. doi: 10.3390/molecules28041827. Molecules. 2023. PMID: 36838816 Free PMC article.

7

Germanium-based superatom clusters as excess electron compounds with significant static and dynamic NLO response; a DFT study.

Ahsin A, Shah AB, Ayub K. Ahsin A, et al. RSC Adv. 2021 Dec 21;12(1):365-377. doi: 10.1039/d1ra08192f. eCollection 2021 Dec 20. RSC Adv. 2021. PMID: 35424493 Free PMC article.

8

Extremely large static and dynamic nonlinear optical response of small superalkali clusters NM₃M' (M, M'=Li, Na, K).

Ahsin A, Ayub K. Ahsin A, et al. J Mol Graph Model. 2021 Dec;109:108031. doi: 10.1016/j.jmgm.2021.108031. Epub 2021 Sep 10. J Mol Graph Model. 2021. PMID: 34536836

9

Oxacarbon superalkali C3X3Y3 (X = O, S and Y = Li, Na, K) clusters as excess electron compounds for remarkable static and dynamic NLO response.

Ahsin A, Ayub K. Ahsin A, et al. J Mol Graph Model. 2021 Jul;106:107922. doi: 10.1016/j.jmgm.2021.107922. Epub 2021 Apr 16. J Mol Graph Model. 2021. PMID: 33984815

10

Alkaline earth metals serving as source of excess electron for alkaline earth metals to impart large second and third order nonlinear optical response; a DFT study.

Ahsin A, Ali A, Ayub K. Ahsin A, et al. J Mol Graph Model. 2020 Dec;101:107759. doi: 10.1016/j.jmgm.2020.107759. Epub 2020 Sep 25. J Mol Graph Model. 2020. PMID: 33011558

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