{"status":"ok","message-type":"work","message-version":"1.0.0","message":{"indexed":{"date-parts":[[2026,10,3]],"date-time":"2026-10-03T04:53:06Z","timestamp":1791003186761,"version":"4.1.0"},"reference-count":87,"publisher":"Wiley","issue":"8","license":[{"start":{"date-parts":[[2026,8,6]],"date-time":"2026-08-06T00:00:00Z","timestamp":1785974400000},"content-version":"vor","delay-in-days":5,"URL":"http:\/\/creativecommons.org\/licenses\/by\/4.0\/"},{"start":{"date-parts":[[2026,8,1]],"date-time":"2026-08-01T00:00:00Z","timestamp":1785542400000},"content-version":"tdm","delay-in-days":0,"URL":"http:\/\/doi.wiley.com\/10.1002\/tdm_license_1.1"}],"content-domain":{"domain":["onlinelibrary.wiley.com"],"crossmark-restriction":true},"short-container-title":["Food Science &amp;amp; Nutrition"],"published-print":{"date-parts":[[2026,8]]},"abstract":"<jats:title>ABSTRACT<\/jats:title>\n                  <jats:p>The monkeypox virus (MPXV) has recently risen to be a significant global health threat and currently there are no approved antiviral agents, which makes it necessary to develop new antiviral strategies. In this study, we employed in silico techniques to investigate whether bacteriocins could be potent inhibitors of the MPXV DNA polymerase (MPDP). At first, the MPXV DNA polymerase enzyme chain was extracted from the Cryo\u2010EM structure of MPXV DNA replication complex and was then assessed using SWISS\u2010MODEL\/QMEAN for structural quality. The structures of selected bacteriocins were either retrieved from the Protein Data Bank or predicted using AlphaFold. The quality of these predicted models was measured by LGscore. Moreover, the physicochemical properties of the selected bacteriocins, such as Sakacin P and Mundticin KS, were analyzed to assess their molecular stability and compatibility with the molecular docking process. The results of protein\u2010peptide docking simulations on the HADDOCK platform showed that among all the bacteriocins tested, Sakacin P and Mundticin KS had the highest binding affinities toward MPXV DNA polymerase. The analysis of the docking experiments also revealed vital stabilizing interactions, such as the formation of hydrogen bonds, ionic linkages, and \u03c0\u2013\u03c0 stacking, which were crucial in the strength of the protein\u2013ligand complexes. Subsequently, the molecular dynamics (MD) simulations further confirmed the stability of the protein\u2013bacteriocin complexes. Our results indicate that bacteriocins, especially Sakacin P and Mundticin KS, can be considered potential antiviral agents against MPXV by interfering with its DNA replication mechanism. The present work shall serve as a reference for future laboratory testing and for the promising innovation of bacteriocin\u2010based drugs targeting MPXV.<\/jats:p>","DOI":"10.1002\/fsn3.72219","type":"journal-article","created":{"date-parts":[[2026,8,7]],"date-time":"2026-08-07T05:43:51Z","timestamp":1786081431000},"update-policy":"https:\/\/doi.org\/10.1002\/crossmark_policy","source":"Crossref","is-referenced-by-count":0,"title":["Virtual Screening of Bacteriocins From Lactic Acid Bacteria Against Monkeypox\n                    <scp>DNA<\/scp>\n                    Polymerase: Sakacin P and Mundticin\n                    <scp>KS<\/scp>\n                    Emerge as Promising Candidates"],"prefix":"10.1002","volume":"14","author":[{"ORCID":"https:\/\/orcid.org\/0009-0008-9007-6776","authenticated-orcid":false,"given":"Melisa Z.","family":"Karaman","sequence":"first","affiliation":[{"name":"Department of Bioengineering, Faculty of Life and Natural Sciences Abdullah Gul University  Kayseri T\u00fcrkiye"}],"role":[{"vocabulary":"crossref","role":"author"}]},{"given":"Karan","family":"Goel","sequence":"additional","affiliation":[{"name":"Chitkara College of Pharmacy Chitkara University  Rajpura Punjab India"}],"role":[{"vocabulary":"crossref","role":"author"}]},{"ORCID":"https:\/\/orcid.org\/0000-0003-3386-0069","authenticated-orcid":false,"given":"Fernando Berton","family":"Zanchi","sequence":"additional","affiliation":[{"name":"Bioinformatic and Medicinal Chemistry Laboratory Fiocruz\/RO  Porto Velho Rond\u00f4nia Brazil"}],"role":[{"vocabulary":"crossref","role":"author"}]},{"given":"Aykut","family":"Ozdarendeli","sequence":"additional","affiliation":[{"name":"Department of Microbiology, Faculty of Medicine Erciyes University Kayseri  Kayseri T\u00fcrkiye"},{"name":"Vaccine Research, Development and Application Centre (ERAGEM) Erciyes University  Kayseri T\u00fcrkiye"}],"role":[{"vocabulary":"crossref","role":"author"}]},{"ORCID":"https:\/\/orcid.org\/0000-0003-4037-5475","authenticated-orcid":false,"given":"Somdutt","family":"Mujwar","sequence":"additional","affiliation":[{"name":"Chitkara College of Pharmacy Chitkara University  Rajpura Punjab India"}],"role":[{"vocabulary":"crossref","role":"author"}]},{"ORCID":"https:\/\/orcid.org\/0000-0001-8406-7226","authenticated-orcid":false,"given":"Ahmet E.","family":"Yetiman","sequence":"additional","affiliation":[{"name":"Department of Food Engineering, Faculty of Engineering Erciyes University  Kayseri T\u00fcrkiye"}],"role":[{"vocabulary":"crossref","role":"author"}]},{"ORCID":"https:\/\/orcid.org\/0000-0001-5312-4742","authenticated-orcid":false,"given":"Ozkan","family":"Fidan","sequence":"additional","affiliation":[{"name":"Department of Bioengineering, Faculty of Life and Natural Sciences Abdullah Gul University  Kayseri 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