{"status":"ok","message-type":"work","message-version":"1.0.0","message":{"indexed":{"date-parts":[[2026,7,23]],"date-time":"2026-07-23T16:46:49Z","timestamp":1784825209531,"version":"3.55.0"},"reference-count":78,"publisher":"Informa UK Limited","issue":"4","content-domain":{"domain":["www.tandfonline.com"],"crossmark-restriction":true},"short-container-title":["Journal of Biomolecular Structure and Dynamics"],"published-print":{"date-parts":[[2025,3,4]]},"DOI":"10.1080\/07391102.2023.2292796","type":"journal-article","created":{"date-parts":[[2025,1,31]],"date-time":"2025-01-31T09:59:56Z","timestamp":1738317596000},"page":"1723-1755","update-policy":"https:\/\/doi.org\/10.1080\/tandf_crossmark_01","source":"Crossref","is-referenced-by-count":11,"title":["1,3,4-oxadiazole derivatives: synthesis, characterization, antifungal activity, DNA binding investigations, TD-DFT calculations, and molecular modelling"],"prefix":"10.1080","volume":"43","author":[{"given":"Rabiya","family":"Mehandi","sequence":"first","affiliation":[{"name":"Molecular and Biophysical Research Laboratory, Department of Chemistry, Jamia Millia Islamia","place":["New Delhi, India"]}],"role":[{"vocabulary":"crossref","role":"author"}]},{"given":"Charmy","family":"Twala","sequence":"additional","affiliation":[{"name":"Department of Life and Consumers Science, University of South Africa","place":["Florida, South Africa"]}],"role":[{"vocabulary":"crossref","role":"author"}]},{"given":"Saiema","family":"Ahmedi","sequence":"additional","affiliation":[{"name":"Department of Biosciences, Jamia Millia Islamia","place":["New Delhi, India"]}],"role":[{"vocabulary":"crossref","role":"author"}]},{"given":"Aysha","family":"Fatima","sequence":"additional","affiliation":[{"name":"S. O. S. in Chemistry, Jiwaji University","place":["Gwalior, India"]}],"role":[{"vocabulary":"crossref","role":"author"}]},{"given":"Khursheed","family":"ul Islam","sequence":"additional","affiliation":[{"name":"Multidisciplinary Center for Advanced Research and Studies, Jamia Millia Islamia","place":["New Delhi, India"]}],"role":[{"vocabulary":"crossref","role":"author"}]},{"given":"Manish","family":"Rana","sequence":"additional","affiliation":[{"name":"Department of Chemistry, Ramjas College, University of Delhi","place":["Delhi, India"]}],"role":[{"vocabulary":"crossref","role":"author"}]},{"given":"Razia","family":"Sultana","sequence":"additional","affiliation":[{"name":"Molecular and Biophysical Research Laboratory, Department of Chemistry, Jamia Millia Islamia","place":["New Delhi, India"]}],"role":[{"vocabulary":"crossref","role":"author"}]},{"given":"Nikhat","family":"Manzoor","sequence":"additional","affiliation":[{"name":"Department of Biosciences, Jamia Millia Islamia","place":["New Delhi, India"]}],"role":[{"vocabulary":"crossref","role":"author"}]},{"ORCID":"https:\/\/orcid.org\/0000-0003-4623-100X","authenticated-orcid":false,"given":"Saleem","family":"Javed","sequence":"additional","affiliation":[{"name":"Department of Chemistry, Jamia Millia Islamia","place":["New Delhi, India"]}],"role":[{"vocabulary":"crossref","role":"author"}]},{"given":"Mohammad","family":"Mahfuzul Haque","sequence":"additional","affiliation":[{"name":"Department of Biotechnology, Jamia Millia Islamia","place":["New Delhi, India"]}],"role":[{"vocabulary":"crossref","role":"author"}]},{"given":"Jawed","family":"Iqbal","sequence":"additional","affiliation":[{"name":"Multidisciplinary Center for Advanced Research and Studies, Jamia Millia Islamia","place":["New Delhi, India"]}],"role":[{"vocabulary":"crossref","role":"author"}]},{"family":"Rahisuddin","sequence":"additional","affiliation":[{"name":"Molecular and Biophysical Research Laboratory, Department of Chemistry, Jamia Millia Islamia","place":["New Delhi, India"]}],"role":[{"vocabulary":"crossref","role":"author"}]},{"given":"Nahid","family":"Nishat","sequence":"additional","affiliation":[{"name":"Department of Chemistry, Jamia Millia Islamia","place":["New Delhi, India"]}],"role":[{"vocabulary":"crossref","role":"author"}]}],"member":"301","published-online":{"date-parts":[[2023,12,21]]},"reference":[{"key":"e_1_3_5_2_1","doi-asserted-by":"publisher","DOI":"10.1016\/j.phyplu.2022.100285"},{"key":"e_1_3_5_3_1","doi-asserted-by":"publisher","DOI":"10.1016\/j.bmc.2012.04.058"},{"issue":"8","key":"e_1_3_5_4_1","first-page":"241","article-title":"Synthesis, characterization, and polymerization of new maleimides containing pendant 1,3,4-oxadiazole moiety","volume":"8","author":"Al-Azzawi A. M.","year":"2016","unstructured":"Al-Azzawi, A. M. & Yaseen, H. K. (2016). Synthesis, characterization, and polymerization of new maleimides containing pendant 1,3,4-oxadiazole moiety. Pharmaceutical Research. 8(8), 241\u2013247.","journal-title":"Pharmaceutical Research"},{"key":"e_1_3_5_5_1","doi-asserted-by":"publisher","DOI":"10.1016\/j.ijbiomac.2020.12.153"},{"key":"e_1_3_5_6_1","doi-asserted-by":"publisher","DOI":"10.1007\/s00044-019-02390-w"},{"key":"e_1_3_5_7_1","doi-asserted-by":"publisher","DOI":"10.1016\/j.jscs.2021.101323"},{"key":"e_1_3_5_8_1","doi-asserted-by":"publisher","DOI":"10.1039\/D0SC00412J"},{"key":"e_1_3_5_9_1","doi-asserted-by":"publisher","DOI":"10.1016\/j.bioorg.2021.104873"},{"key":"e_1_3_5_10_1","doi-asserted-by":"publisher","DOI":"10.1016\/j.ica.2020.119961"},{"key":"e_1_3_5_11_1","doi-asserted-by":"publisher","DOI":"10.1016\/j.ijbiomac.2022.07.177"},{"key":"e_1_3_5_12_1","doi-asserted-by":"publisher","DOI":"10.3390\/jof3040057"},{"key":"e_1_3_5_13_1","doi-asserted-by":"publisher","DOI":"10.1007\/s00216-012-6546-x"},{"key":"e_1_3_5_14_1","doi-asserted-by":"publisher","DOI":"10.1016\/j.ejmech.2017.12.020"},{"key":"e_1_3_5_15_1","doi-asserted-by":"publisher","DOI":"10.1016\/j.bmcl.2020.127028"},{"key":"e_1_3_5_16_1","doi-asserted-by":"publisher","DOI":"10.1016\/j.bbagen.2021.129993"},{"key":"e_1_3_5_17_1","doi-asserted-by":"publisher","DOI":"10.1038\/srep42717"},{"key":"e_1_3_5_18_1","doi-asserted-by":"publisher","DOI":"10.1016\/j.jphotobiol.2015.04.031"},{"key":"e_1_3_5_19_1","doi-asserted-by":"publisher","DOI":"10.1016\/j.molstruc.2021.132216"},{"key":"e_1_3_5_20_1","doi-asserted-by":"publisher","DOI":"10.5582\/ddt.2020.01012"},{"key":"e_1_3_5_21_1","doi-asserted-by":"publisher","DOI":"10.1063\/1.470117"},{"key":"e_1_3_5_22_1","doi-asserted-by":"publisher","DOI":"10.1016\/j.jinorgbio.2021.111425"},{"key":"e_1_3_5_23_1","volume-title":"Gaussian 09, Revision E.01","author":"Frisch M. J.","year":"2009","unstructured":"Frisch, M. J. (2009). Gaussian 09, Revision E.01. Gaussian, Inc.,. Wallingford CT. https:\/\/www.researchgate.net\/publication\/260433987_Gaussian_09_Revision_A02"},{"key":"e_1_3_5_24_1","doi-asserted-by":"publisher","DOI":"10.1126\/science.218.4574.747"},{"key":"e_1_3_5_25_1","doi-asserted-by":"publisher","DOI":"10.1016\/j.molliq.2019.04.004"},{"key":"e_1_3_5_26_1","doi-asserted-by":"publisher","DOI":"10.1016\/j.bioorg.2021.105046"},{"key":"e_1_3_5_27_1","doi-asserted-by":"publisher","DOI":"10.3390\/molecules28083572"},{"key":"e_1_3_5_28_1","doi-asserted-by":"publisher","DOI":"10.4172\/jbb.1000356"},{"key":"e_1_3_5_29_1","doi-asserted-by":"publisher","DOI":"10.1016\/j.ejmech.2020.112046"},{"key":"e_1_3_5_30_1","doi-asserted-by":"publisher","DOI":"10.1016\/j.molstruc.2019.127085"},{"key":"e_1_3_5_31_1","doi-asserted-by":"publisher","DOI":"10.1002\/jhet.3837"},{"key":"e_1_3_5_32_1","doi-asserted-by":"publisher","DOI":"10.1093\/cid\/ciaa1342"},{"key":"e_1_3_5_33_1","doi-asserted-by":"publisher","DOI":"10.1103\/PhysRevA.31.1695"},{"key":"e_1_3_5_34_1","doi-asserted-by":"publisher","DOI":"10.1016\/j.optmat.2012.02.006"},{"key":"e_1_3_5_35_1","unstructured":"International Publication Number: WO 2017\/180587 A2. (n.d.)."},{"key":"e_1_3_5_36_1","doi-asserted-by":"publisher","DOI":"10.1063\/1.445869"},{"key":"e_1_3_5_37_1","doi-asserted-by":"publisher","DOI":"10.1002\/poc.1480"},{"key":"e_1_3_5_38_1","doi-asserted-by":"publisher","DOI":"10.1080\/00268970902821579"},{"key":"e_1_3_5_39_1","doi-asserted-by":"publisher","DOI":"10.1016\/bs.seda.2019.08.001"},{"key":"e_1_3_5_40_1","doi-asserted-by":"publisher","DOI":"10.1042\/BSR20090083"},{"key":"e_1_3_5_41_1","doi-asserted-by":"publisher","DOI":"10.1016\/S0031-8914(34)90011-2"},{"key":"e_1_3_5_42_1","doi-asserted-by":"publisher","DOI":"10.1016\/j.ejmech.2012.10.007"},{"key":"e_1_3_5_43_1","doi-asserted-by":"publisher","DOI":"10.1101\/pdb.prot095505"},{"key":"e_1_3_5_44_1","doi-asserted-by":"publisher","DOI":"10.1016\/j.ica.2021.120440"},{"key":"e_1_3_5_45_1","doi-asserted-by":"publisher","DOI":"10.1016\/j.saa.2020.118454"},{"key":"e_1_3_5_46_1","doi-asserted-by":"publisher","DOI":"10.1002\/chem.200903265"},{"key":"e_1_3_5_47_1","doi-asserted-by":"publisher","DOI":"10.1002\/jcc.22885"},{"key":"e_1_3_5_48_1","doi-asserted-by":"publisher","DOI":"10.1016\/j.bmc.2013.08.002"},{"key":"e_1_3_5_49_1","doi-asserted-by":"publisher","DOI":"10.1016\/j.poly.2020.114559"},{"key":"e_1_3_5_50_1","doi-asserted-by":"publisher","DOI":"10.1039\/C9NJ03573G"},{"key":"e_1_3_5_51_1","doi-asserted-by":"publisher","DOI":"10.3390\/molecules200916852"},{"key":"e_1_3_5_52_1","doi-asserted-by":"publisher","DOI":"10.1002\/hc.20645"},{"key":"e_1_3_5_53_1","doi-asserted-by":"publisher","DOI":"10.1080\/07391102.2015.1109552"},{"key":"e_1_3_5_54_1","doi-asserted-by":"publisher","DOI":"10.1016\/j.jics.2022.100799"},{"key":"e_1_3_5_55_1","doi-asserted-by":"publisher","DOI":"10.1016\/j.molstruc.2021.131248"},{"key":"e_1_3_5_56_1","doi-asserted-by":"publisher","DOI":"10.1007\/s10895-022-03083-1"},{"key":"e_1_3_5_57_1","doi-asserted-by":"publisher","DOI":"10.1163\/156856106778884217"},{"key":"e_1_3_5_58_1","doi-asserted-by":"publisher","DOI":"10.1016\/j.saa.2013.06.011"},{"key":"e_1_3_5_59_1","doi-asserted-by":"publisher","DOI":"10.1016\/j.jpcs.2019.01.013"},{"key":"e_1_3_5_60_1","unstructured":"Northampton M Origin 8.0 OriginLab Corp. (n.d.). No Title."},{"key":"e_1_3_5_61_1","doi-asserted-by":"publisher","DOI":"10.1016\/j.bmcl.2007.11.003"},{"key":"e_1_3_5_62_1","doi-asserted-by":"publisher","DOI":"10.1021\/ja983494x"},{"key":"e_1_3_5_63_1","doi-asserted-by":"publisher","DOI":"10.1063\/1.460447"},{"key":"e_1_3_5_64_1","doi-asserted-by":"publisher","DOI":"10.1063\/1.455064"},{"key":"e_1_3_5_65_1","doi-asserted-by":"publisher","DOI":"10.1016\/j.ica.2021.120601"},{"key":"e_1_3_5_66_1","doi-asserted-by":"publisher","DOI":"10.1016\/j.compbiolchem.2019.05.011"},{"key":"e_1_3_5_67_1","doi-asserted-by":"publisher","DOI":"10.1016\/S0014-827X(00)00056-2"},{"key":"e_1_3_5_68_1","doi-asserted-by":"publisher","DOI":"10.1016\/j.saa.2010.02.010"},{"key":"e_1_3_5_69_1","doi-asserted-by":"publisher","DOI":"10.1038\/srep09137"},{"key":"e_1_3_5_70_1","doi-asserted-by":"publisher","DOI":"10.1080\/07391102.2023.2179541"},{"key":"e_1_3_5_71_1","doi-asserted-by":"publisher","DOI":"10.1016\/j.molstruc.2022.133115"},{"key":"e_1_3_5_72_1","doi-asserted-by":"publisher","DOI":"10.1016\/j.molstruc.2020.128217"},{"key":"e_1_3_5_73_1","doi-asserted-by":"publisher","DOI":"10.1016\/j.bmc.2021.116330"},{"key":"e_1_3_5_74_1","doi-asserted-by":"publisher","DOI":"10.1016\/j.bmc.2015.06.053"},{"key":"e_1_3_5_75_1","doi-asserted-by":"publisher","DOI":"10.1016\/j.saa.2015.04.055"},{"key":"e_1_3_5_76_1","doi-asserted-by":"publisher","DOI":"10.1016\/j.molliq.2021.116944"},{"key":"e_1_3_5_77_1","doi-asserted-by":"publisher","DOI":"10.1016\/j.ica.2020.119674"},{"key":"e_1_3_5_78_1","doi-asserted-by":"publisher","DOI":"10.1016\/j.saa.2020.119116"},{"key":"e_1_3_5_79_1","doi-asserted-by":"publisher","DOI":"10.1016\/j.molliq.2020.115265"}],"container-title":["Journal of Biomolecular Structure and Dynamics"],"original-title":[],"language":"en","link":[{"URL":"https:\/\/www.tandfonline.com\/doi\/pdf\/10.1080\/07391102.2023.2292796","content-type":"unspecified","content-version":"vor","intended-application":"similarity-checking"}],"deposited":{"date-parts":[[2025,2,14]],"date-time":"2025-02-14T07:21:18Z","timestamp":1739517678000},"score":1,"resource":{"primary":{"URL":"https:\/\/www.tandfonline.com\/doi\/full\/10.1080\/07391102.2023.2292796"}},"subtitle":[],"short-title":[],"issued":{"date-parts":[[2023,12,21]]},"references-count":78,"journal-issue":{"issue":"4","published-print":{"date-parts":[[2025,3,4]]}},"alternative-id":["10.1080\/07391102.2023.2292796"],"URL":"https:\/\/doi.org\/10.1080\/07391102.2023.2292796","relation":{},"ISSN":["0739-1102","1538-0254"],"issn-type":[{"value":"0739-1102","type":"print"},{"value":"1538-0254","type":"electronic"}],"subject":[],"published":{"date-parts":[[2023,12,21]]},"assertion":[{"value":"The publishing and review policy for this title is described in its Aims & Scope.","order":1,"name":"peerreview_statement","label":"Peer Review Statement"},{"value":"http:\/\/www.tandfonline.com\/action\/journalInformation?show=aimsScope&journalCode=tbsd20","URL":"http:\/\/www.tandfonline.com\/action\/journalInformation?show=aimsScope&journalCode=tbsd20","order":2,"name":"aims_and_scope_url","label":"Aim & Scope"},{"value":"2023-04-17","order":0,"name":"received","label":"Received","group":{"name":"publication_history","label":"Publication History"}},{"value":"2023-11-25","order":2,"name":"accepted","label":"Accepted","group":{"name":"publication_history","label":"Publication History"}},{"value":"2023-12-21","order":3,"name":"published","label":"Published","group":{"name":"publication_history","label":"Publication History"}}]}}