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For: Sevvanthi S, Muthu S, Raja M, Aayisha S, Janani S. PES, molecular structure, spectroscopic (FT-IR, FT-Raman), electronic (UV-Vis, HOMO-LUMO), quantum chemical and biological (docking) studies on a potent membrane permeable inhibitor: dibenzoxepine derivative. Heliyon 2020;6:e04724. [PMID: 32885075 DOI: 10.1016/j.heliyon.2020.e04724] [Cited by in Crossref: 18] [Cited by in F6Publishing: 17] [Article Influence: 6.0] [Reference Citation Analysis]
Number Citing Articles
1 Celik S. DFT investigations and molecular docking as potent inhibitors of SARS-CoV-2 main protease of 4-phenylpyrimidine. J Mol Struct 2023;1277:134895. [PMID: 36619799 DOI: 10.1016/j.molstruc.2022.134895] [Reference Citation Analysis]
2 Putro PA, Maddu A, Hardhienata H, Isnaeni I, Ahmad F, Dipojono HK. Revealing the incorporation of an NH(2) group into the edge of carbon dots for H(2)O(2) sensing via the C-N⋯H hydrogen bond interaction. Phys Chem Chem Phys 2023;25:2606-17. [PMID: 36602293 DOI: 10.1039/d2cp04097b] [Reference Citation Analysis]
3 Vimala M, Stella Mary S, Irfan A, Muthu S. Solvent role in molecular structure, thermodynamic quantities, reactions and electronic transitions (TDDFT) on 2-[piperidin-1-yl] phenol. Journal of Molecular Liquids 2023. [DOI: 10.1016/j.molliq.2023.121313] [Reference Citation Analysis]
4 Gassoumi B, Dlala NA, Echabaane M, Karayel A, Özkınalı S, Castro ME, Melendez FJ, Ghalla H, Nouar L, Madi F, Chaabane RB. Stability, spectroscopic, electrochemistry and QTAIM analysis of Cu-Zn(n-1)O(n) clusters for glucose sensing application: A study on theoretical and experimental insights. Heliyon 2022;8:e12387. [PMID: 36582723 DOI: 10.1016/j.heliyon.2022.e12387] [Reference Citation Analysis]
5 Jayachitra R, Thilagavathi G, Kanagavalli A, Elangovan N, Sirajunnisa A, Sowrirajan S, Thomas R. Synthesis, Computational, Electronic spectra, and molecular docking studies of 4-((diphenylmethylene)amino)-N-(pyrimidin-2-yl)benzenesulfonamide. Journal of the Indian Chemical Society 2022. [DOI: 10.1016/j.jics.2022.100836] [Reference Citation Analysis]
6 Kanagavalli A, Jayachitra R, Thilagavathi G, Padmavathy M, Elangovan N, Sowrirajan S, Thomas R. Synthesis, structural, spectral, computational, docking and biological activities of Schiff base (E)-4-bromo-2-hydroxybenzylidene) amino)-N-(pyrimidin-2-yl) benzenesulfonamide from 5-bromosalicylaldehyde and sulfadiazine. Journal of the Indian Chemical Society 2022. [DOI: 10.1016/j.jics.2022.100823] [Reference Citation Analysis]
7 Geethapriya J, Shanthidevi A, Arivazhagan M, Elangovan N, Sowrirajan S, Manivel S, Thomas R. Synthesis, characterization, computational, excited state properties, wave function and molecular docking studies of (E)-1-(perfluorophenyl)-N-(p-tolyl) methanimine. Journal of the Indian Chemical Society 2022;99:100785. [DOI: 10.1016/j.jics.2022.100785] [Reference Citation Analysis]
8 Qi J, He X, Lu Q. Novel chelating polyacrylonitrile membrane for efficient capture of Cu2+, Pb2+ and Fe3+. Chemical Engineering Journal 2022;450:138203. [DOI: 10.1016/j.cej.2022.138203] [Cited by in Crossref: 1] [Cited by in F6Publishing: 1] [Article Influence: 1.0] [Reference Citation Analysis]
9 Kanagavalli A, Thilagavathi G, Jayachitra R, Elangovan N, Sowrirajan S, Shadakshara Murthy KR, Thomas R. Synthesis, Electronic Structure, UV–Vis, Wave Function, and Molecular Docking Studies of Schiff Base (Z)-N-(Thiazol-2-yl)-4-((Thiophene-2-ylmethylene)Amino)Benzenesulfonamide. Polycyclic Aromatic Compounds 2022. [DOI: 10.1080/10406638.2022.2150657] [Reference Citation Analysis]
10 Sanakarganesan data T, Elangovan data N, Chandrasekar S, Ganesan E, Balachandran data V, Sowrirajan data S, Balasubramani K, Thomas R. Synthesis, Hirshfeld surface analysis, Computational, Wave function properties, Anticancer and Cytotoxicity activity of di[(p-chlorobenzyl) (dibromo)] (4,7-dimethyl-1,10-phenanthroline)tin (IV) complex. Inorganica Chimica Acta 2022. [DOI: 10.1016/j.ica.2022.121361] [Reference Citation Analysis]
11 Thilagavathi G, Jayachitra R, Kanagavalli A, N E, Sirajunnisa A, S S, Thomas R. Synthesis, computational, and molecular docking studies, photophysical properties of (Z)-N-(pyrimidin-2-yl)-4-(thiophen-2-ylmethylene)amino) benzenesulfonamide. Journal of the Indian Chemical Society 2022. [DOI: 10.1016/j.jics.2022.100835] [Reference Citation Analysis]
12 Jayachitra R, Padmavathy M, Kanagavalli A, Thilagavathi G, Elangovan N, S.sowrirajan, Thomas R. Synthesis, computational, experimental antimicrobial activities and theoretical molecular docking studies of (E)-4-((4-hydroxy-3-methoxy-5-nitrobenzylidene) amino)-N-(thiazole-2-yl) benzenesulfonamide. Journal of the Indian Chemical Society 2022. [DOI: 10.1016/j.jics.2022.100824] [Reference Citation Analysis]
13 Bhaskar C, Elangovan N, Sowrirajan S, Chandrasekar S, Ali OAA, Mahmoud SF, Thomas R. Synthesis, XRD, Hirshfeld surface analysis, DFT studies, cytotoxicity and anticancer activity of di(m-chlorobenzyl) (dichloro) (4, 7-diphenyl-1,10-phenanthroline) tin (IV) complex. Journal of Molecular Structure 2022;1267:133542. [DOI: 10.1016/j.molstruc.2022.133542] [Reference Citation Analysis]
14 Thilagavathi G, Kanagavalli A, Jayachitra R, Padmavathy M, Elangovan N, Thomas R. Synthesis, structural, computational, electronic spectra, wave function properties and molecular docking studies of (Z)-4-(((5-methylfuran-2-yl)methylene)amino)-N-(thiazol-2-yl)benzenesulfonamide. Journal of the Indian Chemical Society 2022. [DOI: 10.1016/j.jics.2022.100786] [Reference Citation Analysis]
15 Sowrirajan S, Elangovan N, Ajithkumar G, Sirajunnisa A, Venkatraman B, Ibrahim MM, Mersal GA, Thomas R. Synthesis, spectral, structural features, electronic properties, biological activities, computational, wave function properties, and molecular docking studies of (E)-4-(((pentafluorophenyl) methylene) amino)-N-(pyrimidin2-yl)benzenesulfonamide. Journal of Molecular Structure 2022;1265:133472. [DOI: 10.1016/j.molstruc.2022.133472] [Cited by in F6Publishing: 2] [Reference Citation Analysis]
16 Chetry N, Karlo T, Devi TG. Intermolecular interaction study of Ag-amino acid biomolecular complex using vibrational spectroscopic techniques and density functional theory method. Journal of Molecular Structure 2022;1266:133410. [DOI: 10.1016/j.molstruc.2022.133410] [Reference Citation Analysis]
17 Muthukumar R, Karnan M, Elangovan N, Karunanidhi M, Sankarapandian V, Thomas R. Synthesis, spectral, computational, wavefunction and molecular docking studies of 4-((thiophene-2-ylmethylene)amino)benzenesulfonamide from sulfanilamide and thiophene-2-carbalaldehyde. Journal of the Indian Chemical Society 2022;99:100718. [DOI: 10.1016/j.jics.2022.100718] [Reference Citation Analysis]
18 Latha A, Elangovan N, Manoj K, Maheswari V, Balachandran V, Balasubramani K, Sowrirajan S, Chandrasekar S, Thomas R. Synthesis, single crystal (XRD), spectral characterization, computational (DFT), quantum chemical modelling and anticancer activity of di(p-bromobenzyl) (dibromo) (1, 10-phenanthroline) tin (IV) complex. Journal of the Indian Chemical Society 2022;99:100714. [DOI: 10.1016/j.jics.2022.100714] [Cited by in F6Publishing: 1] [Reference Citation Analysis]
19 Rajesh R, Muthu S, Sheela N. Investigations of 6-Fluoro-4-Oxo-3,4-Dihydro-2H-Chromene-2-Carboxylic Acid by Quantum Computational, Spectroscopic, TD-DFT with Various Solvents and Molecular Docking Studies. Polycyclic Aromatic Compounds. [DOI: 10.1080/10406638.2022.2124284] [Reference Citation Analysis]
20 Fatima A, Singh M, Abualnaja KM, Althubeiti K, Muthu S, Siddiqui N, Javed S. Experimental Spectroscopic, Structural (Monomer and Dimer), Molecular Docking, Molecular Dynamics Simulation and Hirshfeld Surface Analysis of 2-Amino-6-Methylpyridine. Polycyclic Aromatic Compounds. [DOI: 10.1080/10406638.2022.2080726] [Reference Citation Analysis]
21 Muthukumar R, Karnan M, Elangovan N, Karunanidhi M, Thomas R. Synthesis, spectral analysis, antibacterial activity, quantum chemical studies and supporting molecular docking of Schiff base (E)-4-((4-bromobenzylidene) amino)benzenesulfonamide. Journal of the Indian Chemical Society 2022;99:100405. [DOI: 10.1016/j.jics.2022.100405] [Cited by in Crossref: 7] [Cited by in F6Publishing: 4] [Article Influence: 7.0] [Reference Citation Analysis]
22 Geethapriya J, Shanthidevi A, Arivazhagan M, Elangovan N, Thomas R. Synthesis, structural, DFT, quantum chemical modeling and molecular docking studies of (E)-4-(((5-methylfuran-2-yl)methylene)amino) benzenesulfonamide from 5-methyl-2-furaldehyde and sulfanilamide. Journal of the Indian Chemical Society 2022;99:100418. [DOI: 10.1016/j.jics.2022.100418] [Cited by in Crossref: 6] [Cited by in F6Publishing: 8] [Article Influence: 6.0] [Reference Citation Analysis]
23 Chetry N, Gomti Devi T, Karlo T. Synthesis and characterization of metal complex amino acid using spectroscopic methods and theoretical calculation. Journal of Molecular Structure 2022;1250:131670. [DOI: 10.1016/j.molstruc.2021.131670] [Cited by in Crossref: 5] [Cited by in F6Publishing: 9] [Article Influence: 5.0] [Reference Citation Analysis]
24 Shi C, Liu M, Zhao H, Lv Z, Liang L, Zhang B. A Novel Insight into Screening for Antioxidant Peptides from Hazelnut Protein: Based on the Properties of Amino Acid Residues. Antioxidants 2022;11:127. [DOI: 10.3390/antiox11010127] [Cited by in Crossref: 3] [Cited by in F6Publishing: 3] [Article Influence: 3.0] [Reference Citation Analysis]
25 Muthu S, Aayisha S, Suresh M, Thamarai A, Raj Muhamed R, Raja M. Synthesis, spectroscopic elucidation (FT-IR, FT-Raman, UV–Vis), electronic properties and biological activities (antimicrobial, docking) of semicarbazide derivative. Materials Today: Proceedings 2022;50:2847-52. [DOI: 10.1016/j.matpr.2020.09.569] [Cited by in Crossref: 2] [Cited by in F6Publishing: 2] [Article Influence: 2.0] [Reference Citation Analysis]
26 Suganya S, Saravanan K, Jaganathan R, Kumaradhas P. Salt formation, hydrogen-bonding patterns and supramolecular architectures of acridine with salicylic and hippuric acid molecules. Acta Crystallogr C Struct Chem 2021;77:790-9. [PMID: 34864722 DOI: 10.1107/S2053229621011189] [Reference Citation Analysis]
27 Soykan U, Sert Y, Yıldırım G. DFT, Molecular Docking and Drug-likeness Analysis: Acrylate molecule bearing perfluorinated pendant unit. Journal of Molecular Structure 2021;1244:130940. [DOI: 10.1016/j.molstruc.2021.130940] [Cited by in Crossref: 2] [Cited by in F6Publishing: 2] [Article Influence: 1.0] [Reference Citation Analysis]
28 Bicak B, Kecel Gunduz S, Budama Kilinc Y, Imhof P, Gok B, Akman G, Ozel AE. Structural, spectroscopic, in silico, in vitro and DNA binding evaluations of tyrosyl-lysyl-threonine. J Biomol Struct Dyn 2022;40:12148-64. [PMID: 34463215 DOI: 10.1080/07391102.2021.1968499] [Cited by in Crossref: 1] [Cited by in F6Publishing: 1] [Article Influence: 0.5] [Reference Citation Analysis]
29 Govindammal M, Prasath M, Kamaraj S, Muthu S, Selvapandiyan M. Exploring the molecular structure, vibrational spectroscopic, quantum chemical calculation and molecular docking studies of curcumin: A potential PI3K/AKT uptake inhibitor. Heliyon 2021;7:e06646. [PMID: 33898809 DOI: 10.1016/j.heliyon.2021.e06646] [Cited by in Crossref: 3] [Cited by in F6Publishing: 2] [Article Influence: 1.5] [Reference Citation Analysis]
30 Govindammal M, Prasath M, Selvapandiyan M. Spectroscopic (FT-IR, FT-Raman) investigations, quantum chemical calculations, ADMET and molecular docking studies of phloretin with B-RAF inhibitor. Chem Pap 2021;75:3771-85. [DOI: 10.1007/s11696-021-01576-0] [Cited by in Crossref: 5] [Cited by in F6Publishing: 3] [Article Influence: 2.5] [Reference Citation Analysis]
31 Vidhya V, Austine A, Arivazhagan M. Experimental approach, theoretical investigation and molecular docking of 2- chloro-5-fluoro phenol antibacterial compound. Heliyon 2020;6:e05464. [PMID: 33251354 DOI: 10.1016/j.heliyon.2020.e05464] [Cited by in Crossref: 1] [Cited by in F6Publishing: 1] [Article Influence: 0.3] [Reference Citation Analysis]