{"status":"ok","message-type":"work","message-version":"1.0.0","message":{"indexed":{"date-parts":[[2026,1,13]],"date-time":"2026-01-13T01:07:12Z","timestamp":1768266432043,"version":"3.49.0"},"reference-count":50,"publisher":"Wiley","issue":"4","license":[{"start":{"date-parts":[[2023,4,12]],"date-time":"2023-04-12T00:00:00Z","timestamp":1681257600000},"content-version":"vor","delay-in-days":11,"URL":"http:\/\/creativecommons.org\/licenses\/by\/4.0\/"}],"content-domain":{"domain":["onlinelibrary.wiley.com"],"crossmark-restriction":true},"short-container-title":["Immunity Inflam &amp;amp; Disease"],"published-print":{"date-parts":[[2023,4]]},"abstract":"<jats:title>Abstract<\/jats:title><jats:p>As a result of smallpox immunization programs that ended more than 40 years ago, a significant portion of the world's population is not immune. Moreover, due to the lack of anti\u2010monkeypox drugs and vaccines against monkeypox, the spread of this virus may be the beginning of another challenge. In this study, novel antibodies against monkeypox virus were modeled based on a heavy chain of human antibody and a small peptide fragment. Docking of modeled antibodies with C19L protein showed the range of docking energy, and root\u2010mean\u2010square deviation (RMSD) was from \u2212124 to \u2212154\u2009kcal\/mL and 4\u20136\u2009angstrom, respectively. Also, docking of modeled antibodies\u2010C19L complex with gamma Fc receptor type I illustrated the range of docking energy, and RMSD was from \u2212132 to \u2212155\u2009kcal\/ml and 5\u20137 angstrom, respectively. Moreover, molecular dynamics simulation showed that antibody 62 had the highest stability with the lowest energy level and RMSD. Interestingly, no modeled antibodies had immunogenicity, allergenicity, and toxicity. Although all of them had good stability, only antibodies 25, 28, 54, and 62 had a half\u2010life of &gt;10\u2009h. Moreover, the interaction between C19L protein and anti\u2010C19L antibodies (wild\u2010type and synthetic) was evaluated by the SPR method. We found that K<jats:sub>D<\/jats:sub> in synthetic antibodies was lower than wild antibody. In terms of \u03b4H\u00b0, T\u03b4S\u00b0, and \u03b4G\u00b0, the results were consistent with binding parameters. Here, the lowest value of thermodynamic parameters was obtained for antibody 62. These data show that the synthetic antibodies, especially antibody 62, had a higher affinity than the wild\u2010type antibody.<\/jats:p>","DOI":"10.1002\/iid3.834","type":"journal-article","created":{"date-parts":[[2023,4,12]],"date-time":"2023-04-12T09:30:49Z","timestamp":1681291849000},"update-policy":"https:\/\/doi.org\/10.1002\/crossmark_policy","source":"Crossref","is-referenced-by-count":5,"title":["The validation of artificial anti\u2010monkeypox antibodies by in silico and experimental approaches"],"prefix":"10.1002","volume":"11","author":[{"given":"Sadeq","family":"Shabani","sequence":"first","affiliation":[{"name":"Department of Biological Sciences Florida International University Miami Florida USA"},{"name":"Biomolecular Science Institute Florida International University Miami Florida USA"}],"role":[{"role":"author","vocabulary":"crossref"}]},{"given":"Mohsen","family":"Rashidi","sequence":"additional","affiliation":[{"name":"Department Pharmacology, Faculty of Medicine Mazandaran University of Medical Sciences Sari Iran"},{"name":"The Health of Plant and Livestock Products Research Center Mazandaran University of Medical Sciences Sari Iran"}],"role":[{"role":"author","vocabulary":"crossref"}]},{"given":"Shakila","family":"Radgoudarzi","sequence":"additional","affiliation":[{"name":"I.M. Sechenov First Moscow State Medical University (\u041f\u0435\u0440\u0432\u044b\u0439 \u041c\u0413\u041c\u0423 \u0438\u043c) Moscow Russia"}],"role":[{"role":"author","vocabulary":"crossref"}]},{"ORCID":"https:\/\/orcid.org\/0000-0002-1353-3864","authenticated-orcid":false,"given":"Ali","family":"Jebali","sequence":"additional","affiliation":[{"name":"Department of Medical Nanotechnology, Faculty of Advanced Sciences and Technology, Tehran Medical Science Islamic Azad University Tehran Iran"}],"role":[{"role":"author","vocabulary":"crossref"}]}],"member":"311","published-online":{"date-parts":[[2023,4,12]]},"reference":[{"key":"e_1_2_11_2_1","doi-asserted-by":"publisher","DOI":"10.2807\/1560-7917.ES.2022.27.24.2200482"},{"key":"e_1_2_11_3_1","doi-asserted-by":"publisher","DOI":"10.1111\/j.1699-0463.1959.tb00328.x"},{"issue":"2","key":"e_1_2_11_4_1","first-page":"165","article-title":"Human monkeypox, 1970\u201079","volume":"58","author":"Breman JG","year":"1980","journal-title":"Bull World Health Organ"},{"key":"e_1_2_11_5_1","doi-asserted-by":"publisher","DOI":"10.1056\/NEJMoa032299"},{"key":"e_1_2_11_6_1","doi-asserted-by":"publisher","DOI":"10.3390\/v12111257"},{"key":"e_1_2_11_7_1","doi-asserted-by":"publisher","DOI":"10.1038\/nrmicro1099"},{"key":"e_1_2_11_8_1","doi-asserted-by":"publisher","DOI":"10.3390\/v9110331"},{"key":"e_1_2_11_9_1","volume-title":"Orthopoxviruses Pathogenic for Humans","author":"Shchelkunov SN","year":"2006"},{"key":"e_1_2_11_10_1","doi-asserted-by":"publisher","DOI":"10.1016\/j.meegid.2013.10.014"},{"key":"e_1_2_11_11_1","doi-asserted-by":"publisher","DOI":"10.1093\/ije\/17.3.643"},{"key":"e_1_2_11_12_1","volume-title":"Biosafety in Microbiological and Biomedical Laboratories","author":"Richmond JY","year":"2009"},{"key":"e_1_2_11_13_1","doi-asserted-by":"publisher","DOI":"10.1038\/nm1273"},{"key":"e_1_2_11_14_1","doi-asserted-by":"publisher","DOI":"10.1056\/NEJMoa1705688"},{"key":"e_1_2_11_15_1","doi-asserted-by":"publisher","DOI":"10.1016\/j.ijid.2005.12.001"},{"key":"e_1_2_11_16_1","volume-title":"Smallpox and Its Eradication","author":"Fenner F","year":"1988"},{"key":"e_1_2_11_17_1","doi-asserted-by":"publisher","DOI":"10.1371\/journal.ppat.1003756"},{"key":"e_1_2_11_18_1","doi-asserted-by":"crossref","unstructured":"JonesTC SchneiderJ MuehlemannB et al. 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