{"status":"ok","message-type":"work","message-version":"1.0.0","message":{"indexed":{"date-parts":[[2026,10,22]],"date-time":"2026-10-22T16:17:52Z","timestamp":1792685872041,"version":"4.5.0"},"reference-count":74,"publisher":"Springer Science and Business Media LLC","issue":"3","license":[{"start":{"date-parts":[[2023,6,18]],"date-time":"2023-06-18T00:00:00Z","timestamp":1687046400000},"content-version":"tdm","delay-in-days":0,"URL":"https:\/\/www.springernature.com\/gp\/researchers\/text-and-data-mining"},{"start":{"date-parts":[[2023,6,18]],"date-time":"2023-06-18T00:00:00Z","timestamp":1687046400000},"content-version":"vor","delay-in-days":0,"URL":"https:\/\/www.springernature.com\/gp\/researchers\/text-and-data-mining"}],"funder":[{"DOI":"10.13039\/501100020884","name":"Agencia Nacional de Investigaci\u00f3n y Desarrollo","doi-asserted-by":"publisher","award":["21170159"],"award-info":[{"award-number":["21170159"]}],"id":[{"id":"10.13039\/501100020884","id-type":"DOI","asserted-by":"publisher"}]}],"content-domain":{"domain":["link.springer.com"],"crossmark-restriction":false},"short-container-title":["Acta Parasit."],"published-print":{"date-parts":[[2023,9]]},"DOI":"10.1007\/s11686-023-00692-z","type":"journal-article","created":{"date-parts":[[2023,6,18]],"date-time":"2023-06-18T13:01:20Z","timestamp":1687093280000},"page":"535-547","update-policy":"https:\/\/doi.org\/10.1007\/springer_crossmark_policy","source":"Crossref","is-referenced-by-count":5,"title":["Protein Modelling and Molecular Docking Analysis of Fasciola hepatica \u03b2-Tubulin\u2019s Interaction Sites, with Triclabendazole, Triclabendazole Sulphoxide and Triclabendazole Sulphone"],"prefix":"10.1007","volume":"68","author":[{"ORCID":"https:\/\/orcid.org\/0000-0001-5759-3271","authenticated-orcid":false,"given":"Pamela","family":"Olivares-Ferretti","sequence":"first","affiliation":[],"role":[{"vocabulary":"crossref","role":"author"}]},{"given":"Jorge F.","family":"Beltr\u00e1n","sequence":"additional","affiliation":[],"role":[{"vocabulary":"crossref","role":"author"}]},{"given":"Luis A.","family":"Salazar","sequence":"additional","affiliation":[],"role":[{"vocabulary":"crossref","role":"author"}]},{"ORCID":"https:\/\/orcid.org\/0000-0003-1171-3105","authenticated-orcid":false,"given":"Flery","family":"Fonseca-Salamanca","sequence":"additional","affiliation":[],"role":[{"vocabulary":"crossref","role":"author"}]}],"member":"297","published-online":{"date-parts":[[2023,6,18]]},"reference":[{"key":"692_CR1","doi-asserted-by":"publisher","first-page":"41","DOI":"10.1016\/S0065-308X(09)69002-3","volume":"69","author":"S Mas-Coma","year":"2009","unstructured":"Mas-Coma S, Valero MA, Bargues MD (2009) Chapter 2. Fasciola, lymnaeids and human fascioliasis, with a global overview on disease transmission, epidemiology, evolutionary genetics, molecular epidemiology and control. Adv Parasitol 69:41\u2013146. https:\/\/doi.org\/10.1016\/S0065-308X(09)69002-3","journal-title":"Adv Parasitol"},{"key":"692_CR2","doi-asserted-by":"publisher","first-page":"1021","DOI":"10.1016\/j.ijpara.2010.02.009","volume":"40","author":"C Mccann","year":"2010","unstructured":"Mccann C, Baylis M, Williams D (2010) The development of linear regression models using environmental variables to explain the spatial distribution of Fasciola hepatica infection in dairy herds in England and Wales. Int J Parasitol 40:1021\u20131028. https:\/\/doi.org\/10.1016\/j.ijpara.2010.02.009","journal-title":"Int J Parasitol"},{"key":"692_CR3","doi-asserted-by":"publisher","first-page":"604","DOI":"10.1590\/S1726-46342010000400018","volume":"4","author":"JR Espinoza","year":"2010","unstructured":"Espinoza JR, Terashima A, Herrera-Velit P, Marcos LA (2010) Fasciolosis Humana y Animal en el Per\u00fa: Impacto en la Econom\u00eda de las Zonas End\u00e9micas. Rev Peru Med Exp Salud Publica 4:604\u2013612","journal-title":"Rev Peru Med Exp Salud Publica"},{"key":"692_CR4","doi-asserted-by":"publisher","first-page":"188","DOI":"10.1136\/vr.157.7.188","volume":"157","author":"G Schweizer","year":"2005","unstructured":"Schweizer G, Braun U, Deplazes P, Torgerson PR (2005) Estimating the financial losses due to bovine fasciolosis in Switzerland. Vet Rec 157:188\u2013193. https:\/\/doi.org\/10.1136\/vr.157.7.188","journal-title":"Vet Rec"},{"key":"692_CR5","doi-asserted-by":"publisher","first-page":"326","DOI":"10.1017\/S0031182013001662","volume":"141","author":"J Charlier","year":"2014","unstructured":"Charlier J, Vercruysse J, Morgan E et al (2014) Recent advances in the diagnosis, impact on production and prediction of Fasciola hepatica in cattle. Parasitology 141:326\u2013335. https:\/\/doi.org\/10.1017\/S0031182013001662","journal-title":"Parasitology"},{"key":"692_CR6","unstructured":"World Health Organization (WHO) (2013) Sustaining the drive to overcome the global impact of neglected tropical diseases: second WHO report on neglected tropical diseases. Geneva xii; 140. ISBN:9789241564540"},{"key":"692_CR7","doi-asserted-by":"publisher","first-page":"81","DOI":"10.1053\/tvjl.1999.0377","volume":"158","author":"I Fairweather","year":"1999","unstructured":"Fairweather I, Boray JC (1999) Fasciolicides efficacy, actions, resistance and its management. Vet J 158:81\u2013112","journal-title":"Vet J"},{"key":"692_CR8","doi-asserted-by":"publisher","first-page":"64","DOI":"10.1111\/j.1365-2885.1987.tb00078.x","volume":"10","author":"DR Hennessy","year":"1987","unstructured":"Hennessy DR, Lacey E, Steel JW, Prichard RK (1987) The kinetics of triclabendazole disposition in sheep. J Vet Pharmacol Ther 10:64\u201372. https:\/\/doi.org\/10.1111\/j.1365-2885.1987.tb00078.x","journal-title":"J Vet Pharmacol Ther"},{"key":"692_CR9","doi-asserted-by":"publisher","first-page":"3535","DOI":"10.1128\/AAC.06345-11","volume":"56","author":"B Barrera","year":"2012","unstructured":"Barrera B, Otero JA, Egido E et al (2012) The anthelmintic triclabendazole and its metabolites inhibit the membrane transporter ABCG2\/BCRP. Antimicrob Agents Chemother 56:3535\u20133543. https:\/\/doi.org\/10.1128\/AAC.06345-11","journal-title":"Antimicrob Agents Chemother"},{"key":"692_CR10","doi-asserted-by":"publisher","first-page":"104","DOI":"10.1016\/j.yexmp.2007.01.009","volume":"82","author":"GP Brennan","year":"2007","unstructured":"Brennan GP, Fairweather I, Trudgett A et al (2007) Understanding triclabendazole resistance. Exp Mol Pathol 82:104\u2013109. https:\/\/doi.org\/10.1016\/j.yexmp.2007.01.009","journal-title":"Exp Mol Pathol"},{"key":"692_CR11","doi-asserted-by":"publisher","first-page":"672","DOI":"10.1017\/S0022149X16000705","volume":"91","author":"MMO Abdelaal","year":"2017","unstructured":"Abdelaal MMO, Brennan GP, Abdel-Aziz A, Fairweather I (2017) Ultrastructural changes to the tegumental system and gastrodermal cells of adult Fasciola hepatica following treatment in vivo with a commercial preparation of myrrh (Mirazid). J Helminthol 91:672\u2013685. https:\/\/doi.org\/10.1017\/S0022149X16000705","journal-title":"J Helminthol"},{"key":"692_CR12","doi-asserted-by":"publisher","first-page":"227","DOI":"10.1079\/joh2005298","volume":"79","author":"I Fairweather","year":"2005","unstructured":"Fairweather I (2005) Triclabendazole: new skills to unravel an old(ish) enigma. J Helminthol 79:227\u2013234. https:\/\/doi.org\/10.1079\/joh2005298","journal-title":"J Helminthol"},{"key":"692_CR13","doi-asserted-by":"publisher","first-page":"139","DOI":"10.1017\/S0022149X09321173","volume":"83","author":"I Fairweather","year":"2009","unstructured":"Fairweather I (2009) Triclabendazole progress report, 2005\u20132009: an advancement of learning? J Helminthol 83:139\u2013150. https:\/\/doi.org\/10.1017\/S0022149X09321173","journal-title":"J Helminthol"},{"key":"692_CR14","doi-asserted-by":"publisher","first-page":"133","DOI":"10.1016\/j.vetpar.2011.05.034","volume":"180","author":"I Fairweather","year":"2011","unstructured":"Fairweather I (2011) Reducing the future threat from (liver) fluke: realistic prospect or quixotic fantasy? Vet Parasitol 180:133\u2013143. https:\/\/doi.org\/10.1016\/j.vetpar.2011.05.034","journal-title":"Vet Parasitol"},{"key":"692_CR15","doi-asserted-by":"publisher","first-page":"365","DOI":"10.1007\/s00436-006-0270-4","volume":"100","author":"M McConville","year":"2007","unstructured":"McConville M, Brennan GP, McCoy M et al (2007) Immature triclabendazole-resistant Fasciola hepatica: tegumental responses to in vitro treatment with the sulphoxide metabolite of the experimental fasciolicide compound alpha. Parasitol Res 100:365\u2013377. https:\/\/doi.org\/10.1007\/s00436-006-0270-4","journal-title":"Parasitol Res"},{"key":"692_CR16","doi-asserted-by":"publisher","first-page":"431","DOI":"10.3390\/pathogens4030431","volume":"4","author":"R Hanna","year":"2015","unstructured":"Hanna R (2015) Fasciola hepatica: histology of the reproductive organs and differential effects of triclabendazole on drug-sensitive and drug-resistant fluke isolates and on flukes from selected field cases. Pathogens 4:431\u2013456. https:\/\/doi.org\/10.3390\/pathogens4030431","journal-title":"Pathogens"},{"key":"692_CR17","doi-asserted-by":"publisher","first-page":"336","DOI":"10.1515\/ap-2017-0041","volume":"62","author":"MMO Abdelaal","year":"2017","unstructured":"Abdelaal MMO, Brennan GP, Hanna REB et al (2017) Disruption of egg production by triclabendazole-resistant Fasciola hepatica following treatment with a commercial preparation of myrrh (Mirazid). Acta Parasitol 62:336\u2013347. https:\/\/doi.org\/10.1515\/ap-2017-0041","journal-title":"Acta Parasitol"},{"key":"692_CR18","doi-asserted-by":"publisher","first-page":"333","DOI":"10.1007\/s004360050122","volume":"82","author":"AW Stitt","year":"1996","unstructured":"Stitt AW, Fairweather I (1996) Fasciola hepatica: disruption of the vitelline cells in vitro by the sulphoxide metabolite of triclabendazole. Parasitol Res 82:333\u2013339. https:\/\/doi.org\/10.1007\/s004360050122","journal-title":"Parasitol Res"},{"key":"692_CR19","doi-asserted-by":"publisher","first-page":"195","DOI":"10.1017\/S0031182006000114","volume":"133","author":"M McConville","year":"2006","unstructured":"McConville M, Brennan GP, McCoy M et al (2006) Adult triclabendazole-resistant Fasciola hepatica: surface and subsurface tegumental responses to in vitro treatment with the sulphoxide metabolite of the experimental fasciolicide compound alpha. Parasitology 133:195\u2013208. https:\/\/doi.org\/10.1017\/S0031182006000114","journal-title":"Parasitology"},{"key":"692_CR20","doi-asserted-by":"publisher","first-page":"325","DOI":"10.1017\/S003118200100124X","volume":"124","author":"MW Robinson","year":"2002","unstructured":"Robinson MW, Trudgett A, Hoey EM, Fairweather I (2002) Triclabendazole-resistant Fasciola hepatica: \u03b2-tubulin and response to in vitro treatment with triclabendazole. Parasitology 124:325\u2013338. https:\/\/doi.org\/10.1017\/S003118200100124X","journal-title":"Parasitology"},{"key":"692_CR21","doi-asserted-by":"publisher","first-page":"126","DOI":"10.1016\/j.vetpar.2008.10.007","volume":"159","author":"L Halferty","year":"2009","unstructured":"Halferty L, Brennan GP, Trudgett A et al (2009) Relative activity of triclabendazole metabolites against the liver fluke, Fasciola hepatica. Vet Parasitol 159:126\u2013138. https:\/\/doi.org\/10.1016\/j.vetpar.2008.10.007","journal-title":"Vet Parasitol"},{"key":"692_CR22","doi-asserted-by":"publisher","first-page":"1912","DOI":"10.1002\/pro.2808","volume":"24","author":"E Nogales","year":"2015","unstructured":"Nogales E (2015) An electron microscopy journey in the study of microtubule structure and dynamics. Protein Sci 24:1912\u20131919. https:\/\/doi.org\/10.1002\/pro.2808","journal-title":"Protein Sci"},{"key":"692_CR23","doi-asserted-by":"publisher","first-page":"199","DOI":"10.1107\/S2052252519011497","volume":"8","author":"E Nogales","year":"1998","unstructured":"Nogales E, Wolf SG, Downing KH (1998) Structure of the ab tubulin dimer by electron crystallography. Nature 8:199\u2013203. https:\/\/doi.org\/10.1107\/S2052252519011497","journal-title":"Nature"},{"key":"692_CR24","doi-asserted-by":"publisher","first-page":"12","DOI":"10.1016\/j.jmgm.2013.01.007","volume":"41","author":"R Aguayo-Ortiz","year":"2013","unstructured":"Aguayo-Ortiz R, M\u00e9ndez-Lucio O, Medina-Franco JL et al (2013) Towards the identification of the binding site of benzimidazoles to \u03b2-tubulin of Trichinella spiralis: insights from computational and experimental data. J Mol Graph Model 41:12\u201319. https:\/\/doi.org\/10.1016\/j.jmgm.2013.01.007","journal-title":"J Mol Graph Model"},{"key":"692_CR25","doi-asserted-by":"publisher","first-page":"26","DOI":"10.1016\/j.jmgm.2013.07.008","volume":"45","author":"R Aguayo-Ortiz","year":"2013","unstructured":"Aguayo-Ortiz R, M\u00e9ndez-Lucio O, Romo-Mancillas A et al (2013) Molecular basis for benzimidazole resistance from a novel \u03b2-tubulin binding site model. J Mol Graph Model 45:26\u201337. https:\/\/doi.org\/10.1016\/j.jmgm.2013.07.008","journal-title":"J Mol Graph Model"},{"key":"692_CR26","doi-asserted-by":"publisher","first-page":"73","DOI":"10.1016\/j.molbiopara.2008.02.001","volume":"159","author":"LA Ryan","year":"2008","unstructured":"Ryan LA, Hoey E, Trudgett A et al (2008) Fasciola hepatica expresses multiple \u03b1- and \u03b2-tubulin isotypes. Mol Biochem Parasitol 159:73\u201378. https:\/\/doi.org\/10.1016\/j.molbiopara.2008.02.001","journal-title":"Mol Biochem Parasitol"},{"key":"692_CR27","doi-asserted-by":"publisher","first-page":"275","DOI":"10.1016\/j.jmgm.2004.08.001","volume":"23","author":"MW Robinson","year":"2004","unstructured":"Robinson MW, McFerran N, Trudgett A et al (2004) A possible model of benzimidazole binding to \u03b2-tubulin disclosed by invoking an inter-domain movement. J Mol Graph Model 23:275\u2013284. https:\/\/doi.org\/10.1016\/j.jmgm.2004.08.001","journal-title":"J Mol Graph Model"},{"key":"692_CR28","doi-asserted-by":"publisher","first-page":"1257","DOI":"10.1007\/s00436-010-1997-5","volume":"107","author":"E Chambers","year":"2010","unstructured":"Chambers E, Ryan LA, Hoey EM et al (2010) Liver fluke \u03b2-tubulin isotype 2 binds albendazole and is thus a probable target of this drug. Parasitol Res 107:1257\u20131264. https:\/\/doi.org\/10.1007\/s00436-010-1997-5","journal-title":"Parasitol Res"},{"key":"692_CR29","doi-asserted-by":"publisher","first-page":"13331","DOI":"10.1002\/anie.202100273","volume":"60","author":"T M\u00fchlethaler","year":"2021","unstructured":"M\u00fchlethaler T, Gioia D, Prota AE et al (2021) Comprehensive analysis of binding sites in tubulin. Angew Chem Int Ed 60:13331\u201313342. https:\/\/doi.org\/10.1002\/anie.202100273","journal-title":"Angew Chem Int Ed"},{"key":"692_CR30","doi-asserted-by":"publisher","first-page":"310","DOI":"10.1016\/j.ejmech.2019.03.025","volume":"171","author":"F Naaz","year":"2019","unstructured":"Naaz F, Haider MR, Shafi S, Yar MS (2019) Anti-tubulin agents of natural origin: targeting taxol, vinca, and colchicine binding domains. Eur J Med Chem 171:310\u2013331. https:\/\/doi.org\/10.1016\/j.ejmech.2019.03.025","journal-title":"Eur J Med Chem"},{"key":"692_CR31","doi-asserted-by":"publisher","first-page":"11765","DOI":"10.1074\/jbc.M110.162214","volume":"286","author":"M Khrapunovich-Baine","year":"2011","unstructured":"Khrapunovich-Baine M, Menon V, Yang CPH et al (2011) Hallmarks of molecular action of microtubule stabilizing agents: effects of epothilone B, ixabepilone, peloruside A, and laulimalide on microtubule conformation. J Biol Chem 286:11765\u201311778. https:\/\/doi.org\/10.1074\/jbc.M110.162214","journal-title":"J Biol Chem"},{"key":"692_CR32","doi-asserted-by":"publisher","first-page":"235","DOI":"10.1107\/S0907444902003451","volume":"8","author":"HM Berman","year":"2000","unstructured":"Berman HM, Battistuz T, Bhat TN et al (2000) The protein data bank. Nucleic Acids Res 8:235\u2013242. https:\/\/doi.org\/10.1107\/S0907444902003451","journal-title":"Nucleic Acids Res"},{"key":"692_CR33","doi-asserted-by":"publisher","first-page":"1792","DOI":"10.1093\/nar\/gkh340","volume":"32","author":"RC Edgar","year":"2004","unstructured":"Edgar RC (2004) MUSCLE: multiple sequence alignment with high accuracy and high throughput. Nucleic Acids Res 32:1792\u20131797. https:\/\/doi.org\/10.1093\/nar\/gkh340","journal-title":"Nucleic Acids Res"},{"key":"692_CR34","doi-asserted-by":"publisher","first-page":"451","DOI":"10.1038\/nsb0698-451","volume":"5","author":"E Nogales","year":"1998","unstructured":"Nogales E, Downing KH, Amos LA, Lowe J (1998) Tubulin and FtsZ form a distinct family of GTPases. Nat Struct Biol 5:451\u2013458","journal-title":"Nat Struct Biol"},{"key":"692_CR35","doi-asserted-by":"publisher","first-page":"W443","DOI":"10.1093\/nar\/gkv315","volume":"43","author":"S Salentin","year":"2015","unstructured":"Salentin S, Schreiber S, Haupt VJ et al (2015) PLIP: fully automated protein-ligand interaction profiler. Nucleic Acids Res 43:W443\u2013W447. https:\/\/doi.org\/10.1093\/nar\/gkv315","journal-title":"Nucleic Acids Res"},{"key":"692_CR36","doi-asserted-by":"publisher","first-page":"583","DOI":"10.1038\/s41586-021-03819-2","volume":"596","author":"J Jumper","year":"2021","unstructured":"Jumper J, Evans R, Pritzel A et al (2021) Highly accurate protein structure prediction with AlphaFold. Nature 596:583\u2013589. https:\/\/doi.org\/10.1038\/s41586-021-03819-2","journal-title":"Nature"},{"key":"692_CR37","doi-asserted-by":"publisher","first-page":"679","DOI":"10.1038\/s41592-022-01488-1","volume":"19","author":"M Mirdita","year":"2022","unstructured":"Mirdita M, Sch\u00fctze K, Moriwaki Y et al (2022) ColabFold: making protein folding accessible to all. Nat Methods 19:679\u2013682. https:\/\/doi.org\/10.1038\/s41592-022-01488-1","journal-title":"Nat Methods"},{"key":"692_CR38","doi-asserted-by":"publisher","first-page":"712","DOI":"10.1002\/prot.21123","volume":"65","author":"V Hornak","year":"2006","unstructured":"Hornak V, Abel R, Okur A et al (2006) Comparison of multiple amber force fields and development of improved protein backbone parameters. Proteins Struct Funct Genet 65:712\u2013725. https:\/\/doi.org\/10.1002\/prot.21123","journal-title":"Proteins Struct Funct Genet"},{"key":"692_CR39","doi-asserted-by":"publisher","first-page":"162","DOI":"10.1002\/elps.200900140","volume":"30","author":"N Guex","year":"2009","unstructured":"Guex N, Peitsch MC, Schwede T (2009) Automated comparative protein structure modeling with SWISS-MODEL and Swiss-PdbViewer: a historical perspective. Electrophoresis 30:162\u2013173. https:\/\/doi.org\/10.1002\/elps.200900140","journal-title":"Electrophoresis"},{"key":"692_CR40","doi-asserted-by":"publisher","first-page":"12","DOI":"10.1107\/S0907444909042073","volume":"66","author":"VB Chen","year":"2010","unstructured":"Chen VB, Arendall WB, Headd JJ et al (2010) MolProbity: all-atom structure validation for macromolecular crystallography. Acta Crystallogr Sect D Biol Crystallogr 66:12\u201321. https:\/\/doi.org\/10.1107\/S0907444909042073","journal-title":"Acta Crystallogr Sect D Biol Crystallogr"},{"key":"692_CR41","doi-asserted-by":"publisher","first-page":"W296","DOI":"10.1093\/nar\/gky427","volume":"46","author":"A Waterhouse","year":"2018","unstructured":"Waterhouse A, Bertoni M, Bienert S et al (2018) SWISS-MODEL: homology modelling of protein structures and complexes. Nucleic Acids Res 46:W296\u2013W303. https:\/\/doi.org\/10.1093\/nar\/gky427","journal-title":"Nucleic Acids Res"},{"key":"692_CR42","doi-asserted-by":"publisher","first-page":"407","DOI":"10.1093\/nar\/gkm290","volume":"35","author":"M Wiederstein","year":"2007","unstructured":"Wiederstein M, Sippl MJ (2007) ProSA-web: interactive web service for the recognition of errors in three-dimensional structures of proteins. Nucleic Acids Res 35:407\u2013410. https:\/\/doi.org\/10.1093\/nar\/gkm290","journal-title":"Nucleic Acids Res"},{"key":"692_CR43","doi-asserted-by":"publisher","first-page":"355","DOI":"10.1002\/prot.340170404","volume":"17","author":"MJ Sippl","year":"1993","unstructured":"Sippl MJ (1993) Recognition of errors in three-dimensional structures of proteins. Proteins Struct Funct Bioinform 17:355\u2013362. https:\/\/doi.org\/10.1002\/prot.340170404","journal-title":"Proteins Struct Funct Bioinform"},{"key":"692_CR44","doi-asserted-by":"publisher","first-page":"19","DOI":"10.1016\/j.softx.2015.06.001","volume":"1\u20132","author":"MJ Abraham","year":"2015","unstructured":"Abraham MJ, Murtola T, Schulz R et al (2015) Gromacs: High performance molecular simulations through multi-level parallelism from laptops to supercomputers. SoftwareX 1\u20132:19\u201325. https:\/\/doi.org\/10.1016\/j.softx.2015.06.001","journal-title":"SoftwareX"},{"key":"692_CR45","doi-asserted-by":"publisher","first-page":"71","DOI":"10.1038\/nmeth.4067","volume":"14","author":"J Huang","year":"2016","unstructured":"Huang J, Rauscher S, Nawrocki G et al (2016) CHARMM36m: an improved force field for folded and intrinsically disordered proteins. Nat Methods 14:71\u201373. https:\/\/doi.org\/10.1038\/nmeth.4067","journal-title":"Nat Methods"},{"key":"692_CR46","doi-asserted-by":"publisher","unstructured":"Maxwell JC (1890) The scientific papers. Cambridge University Press, Cambridge. https:\/\/doi.org\/10.1017\/CBO9780511710377","DOI":"10.1017\/CBO9780511710377"},{"key":"692_CR47","doi-asserted-by":"publisher","first-page":"7182","DOI":"10.1063\/1.328693","volume":"52","author":"M Parrinello","year":"1981","unstructured":"Parrinello M, Rahman A (1981) Polymorphic transitions in single crystals: a new molecular dynamics method. J Appl Phys 52:7182\u20137190. https:\/\/doi.org\/10.1063\/1.328693","journal-title":"J Appl Phys"},{"key":"692_CR48","doi-asserted-by":"publisher","first-page":"D1202","DOI":"10.1093\/nar\/gkv951","volume":"44","author":"S Kim","year":"2016","unstructured":"Kim S, Thiessen PA, Bolton EE et al (2016) PubChem substance and compound databases. Nucleic Acids Res 44:D1202\u2013D1213. https:\/\/doi.org\/10.1093\/nar\/gkv951","journal-title":"Nucleic Acids Res"},{"key":"692_CR49","doi-asserted-by":"crossref","first-page":"455","DOI":"10.1002\/jcc.21334","volume":"31","author":"O Trott","year":"2010","unstructured":"Trott O, Olson AJ (2010) Software news and update AutoDock vina: improving the speed and accuracy of docking with a new scoring function, efficient optimization, and multithreading. J Comput Chem 31:455\u2013461","journal-title":"J Comput Chem"},{"key":"692_CR50","doi-asserted-by":"publisher","first-page":"243","DOI":"10.1007\/978-1-4939-2269-7_19","volume":"1263","author":"S Dallakyan","year":"2015","unstructured":"Dallakyan S, Olson AJ (2015) Small-molecule library screening by docking with PyRx. Methods Mol Biol 1263:243\u2013250. https:\/\/doi.org\/10.1007\/978-1-4939-2269-7_19","journal-title":"Methods Mol Biol"},{"key":"692_CR51","doi-asserted-by":"publisher","first-page":"616","DOI":"10.1002\/(SICI)1096-987X(199604)17:5\/6<616::AID-JCC5>3.0.CO;2-X","volume":"17","author":"TA Halgren","year":"1996","unstructured":"Halgren TA (1996) Merck molecular force field. V. Extension of MMFF94 using experimental data, additional computational data, and empirical rules. J Comput Chem 17:616\u2013641. https:\/\/doi.org\/10.1002\/(SICI)1096-987X(199604)17:5\/6%3c616::AID-JCC5%3e3.0.CO;2-X","journal-title":"J Comput Chem"},{"key":"692_CR52","doi-asserted-by":"publisher","first-page":"1045","DOI":"10.1006\/jmbi.2001.5077","volume":"313","author":"J L\u00f6we","year":"2001","unstructured":"L\u00f6we J, Li H, Downing KH, Nogales E (2001) Refined structure of \u03b1\u03b2-tubulin at 3.5 \u00c5 resolution. J Mol Biol 313:1045\u20131057. https:\/\/doi.org\/10.1006\/jmbi.2001.5077","journal-title":"J Mol Biol"},{"key":"692_CR53","doi-asserted-by":"publisher","first-page":"D306","DOI":"10.1093\/nar\/gkj105","volume":"34","author":"T Castrignan\u00f2","year":"2006","unstructured":"Castrignan\u00f2 T, De Meo PD, Cozzetto D et al (2006) The PMDB protein model database. Nucleic Acids Res 34:D306\u2013D309. https:\/\/doi.org\/10.1093\/nar\/gkj105","journal-title":"Nucleic Acids Res"},{"key":"692_CR54","doi-asserted-by":"publisher","first-page":"4940","DOI":"10.1021\/pr1000785","volume":"9","author":"G Chemale","year":"2010","unstructured":"Chemale G, Perally S, Lacourse EJ et al (2010) Comparative proteomic analysis of triclabendazole response in the liver fluke Fasciola hepatica. J Proteome Res 9:4940\u20134951. https:\/\/doi.org\/10.1021\/pr1000785","journal-title":"J Proteome Res"},{"key":"692_CR55","doi-asserted-by":"publisher","first-page":"1","DOI":"10.1186\/s13071-017-2553-2","volume":"11","author":"S Radio","year":"2018","unstructured":"Radio S, Fontenla S, Solana V et al (2018) Pleiotropic alterations in gene expression in Latin American Fasciola hepatica isolates with different susceptibility to drugs. Parasit Vectors 11:1\u201311. https:\/\/doi.org\/10.1186\/s13071-017-2553-2","journal-title":"Parasit Vectors"},{"key":"692_CR56","doi-asserted-by":"publisher","first-page":"83","DOI":"10.1146\/annurev.cellbio.13.1.83","volume":"13","author":"A Desai","year":"1997","unstructured":"Desai A, Mitchison TJ (1997) Microtubule polymerization dynamics. Annu Rev Cell Dev Biol 13:83\u2013117. https:\/\/doi.org\/10.1146\/annurev.cellbio.13.1.83","journal-title":"Annu Rev Cell Dev Biol"},{"key":"692_CR57","doi-asserted-by":"publisher","first-page":"R65","DOI":"10.1016\/S1074-5521(99)89002-4","volume":"6","author":"LA Amos","year":"1999","unstructured":"Amos LA, Lowe J (1999) How Taxol(R) stabilises microtubule structure. Chem Biol 6:R65\u2013R69","journal-title":"Chem Biol"},{"key":"692_CR58","doi-asserted-by":"publisher","first-page":"1077","DOI":"10.1017\/S0031182007000054","volume":"134","author":"G Von Samson-Himmelstjerna","year":"2007","unstructured":"Von Samson-Himmelstjerna G, Blackhall WJ, McCarthy JS, Skuce PJ (2007) Single nucleotide polymorphism (SNP) markers for benzimidazole resistance in veterinary nematodes. Parasitology 134:1077\u20131086. https:\/\/doi.org\/10.1017\/S0031182007000054","journal-title":"Parasitology"},{"key":"692_CR59","doi-asserted-by":"publisher","first-page":"299","DOI":"10.1016\/0166-6851(94)90066-3","volume":"63","author":"MS Kwa","year":"1994","unstructured":"Kwa MS, Veenstra JG, Roos MH (1994) Benzimidazole resistance in Haemonchus contortus is correlated with a conserved mutation at amino acid 200 in beta-tubulin isotype 1. Mol Biochem Parasitol 63:299\u2013303. https:\/\/doi.org\/10.1016\/0166-6851(94)90066-3","journal-title":"Mol Biochem Parasitol"},{"key":"692_CR60","doi-asserted-by":"publisher","first-page":"1133","DOI":"10.1016\/j.ijpara.2013.08.007","volume":"43","author":"MA Fuchs","year":"2013","unstructured":"Fuchs MA, Ryan LA, Chambers EL et al (2013) Differential expression of liver fluke \u03b2-tubulin isotypes at selected life cycle stages. Int J Parasitol 43:1133\u20131139. https:\/\/doi.org\/10.1016\/j.ijpara.2013.08.007","journal-title":"Int J Parasitol"},{"key":"692_CR61","doi-asserted-by":"publisher","first-page":"998","DOI":"10.2307\/3282756","volume":"77","author":"KB Lipkowitz","year":"1991","unstructured":"Lipkowitz KB, McCracken RO (1991) A molecular modeling approach to in vivo efficacy of triclabendazole. J Parasitol 77:998\u20131005. https:\/\/doi.org\/10.2307\/3282756","journal-title":"J Parasitol"},{"key":"692_CR62","doi-asserted-by":"publisher","DOI":"10.1016\/j.ijpddr.2019.11.003","author":"I Fairweather","year":"2020","unstructured":"Fairweather I, Brennan GP, Robinson MW, Skuce PJ (2020) Drug resistance in liver flukes. Int J Parasitol Drugs Drug Resist. https:\/\/doi.org\/10.1016\/j.ijpddr.2019.11.003","journal-title":"Int J Parasitol Drugs Drug Resist"},{"key":"692_CR63","doi-asserted-by":"publisher","first-page":"203","DOI":"10.1016\/0014-4894(91)90023-P","volume":"73","author":"GW Lubega","year":"1991","unstructured":"Lubega GW, Prichard RK (1991) Interaction of benzimidazole anthelmintics with Haemonchus contortus tubulin: binding affinity and anthelmintic efficacy. Exp Parasitol 73:203\u2013213. https:\/\/doi.org\/10.1016\/0014-4894(91)90023-P","journal-title":"Exp Parasitol"},{"key":"692_CR64","doi-asserted-by":"publisher","first-page":"89","DOI":"10.1016\/0304-4017(91)90065-4","volume":"39","author":"A Jim\u00e9nez-Gonz\u00e1lez","year":"1991","unstructured":"Jim\u00e9nez-Gonz\u00e1lez A, De Armas-Serra C, Criado-Fornelio A et al (1991) Preliminary characterization and interaction of tubulin from Trichinella spiralis larvae with benzimidazole derivatives. Vet Parasitol 39:89\u201399. https:\/\/doi.org\/10.1016\/0304-4017(91)90065-4","journal-title":"Vet Parasitol"},{"key":"692_CR65","doi-asserted-by":"publisher","first-page":"2943","DOI":"10.1007\/s11095-012-0828-z","volume":"29","author":"Y Lu","year":"2012","unstructured":"Lu Y, Chen J, Xiao M et al (2012) An overview of tubulin inhibitors that interact with the colchicine binding site. Pharm Res 29:2943\u20132971. https:\/\/doi.org\/10.1007\/s11095-012-0828-z","journal-title":"Pharm Res"},{"key":"692_CR66","doi-asserted-by":"publisher","first-page":"1289","DOI":"10.2174\/1568026619666190618130008","volume":"19","author":"Y Duan","year":"2019","unstructured":"Duan Y, Liu W, Tian L et al (2019) Targeting tubulin-colchicine site for cancer therapy: inhibitors, antibody\u2013drug conjugates and degradation agents. Curr Top Med Chem 19:1289\u20131304. https:\/\/doi.org\/10.2174\/1568026619666190618130008","journal-title":"Curr Top Med Chem"},{"key":"692_CR67","doi-asserted-by":"publisher","first-page":"31672","DOI":"10.1074\/jbc.M110.141929","volume":"285","author":"P Barbier","year":"2010","unstructured":"Barbier P, Dorl\u00e9ans A, Devred F et al (2010) Stathmin and interfacial microtubule inhibitors recognize a naturally curved conformation of tubulin dimers. J Biol Chem 285:31672\u201331681. https:\/\/doi.org\/10.1074\/jbc.M110.141929","journal-title":"J Biol Chem"},{"key":"692_CR68","doi-asserted-by":"publisher","first-page":"198","DOI":"10.1038\/nature02393","volume":"428","author":"RBG Ravelli","year":"2004","unstructured":"Ravelli RBG, Gigant B, Curmi PA et al (2004) Insight into tubulin regulation from a complex with colchicine and a stathmin-like domain. Nature 428:198\u2013202. https:\/\/doi.org\/10.1038\/nature02393","journal-title":"Nature"},{"key":"692_CR69","doi-asserted-by":"publisher","first-page":"49","DOI":"10.1111\/j.1365-2885.1986.tb00011.x","volume":"9","author":"RH Fetterer","year":"1986","unstructured":"Fetterer RH (1986) The effect of albendazole and triclabendazole on colchicine binding in the liver fluke Fasciola hepatica. J Vet Pharmacol Ther 9:49\u201354. https:\/\/doi.org\/10.1111\/j.1365-2885.1986.tb00011.x","journal-title":"J Vet Pharmacol Ther"},{"key":"692_CR70","first-page":"1231","volume":"4","author":"M Moudi","year":"2013","unstructured":"Moudi M, Go R, Yien CYS, Nazre M (2013) Vinca alkaloids. Int J Prev Med 4:1231\u20131235","journal-title":"Int J Prev Med"},{"issue":"Suppl 4","key":"692_CR71","doi-asserted-by":"publisher","first-page":"1","DOI":"10.2165\/00003495-199200444-00002","volume":"44","author":"XJ Zhou","year":"1992","unstructured":"Zhou XJ, Rahmani R (1992) Preclinical and clinical pharmacology of vinca alkaloids. Drugs 44(Suppl 4):1\u20139. https:\/\/doi.org\/10.2165\/00003495-199200444-00002","journal-title":"Drugs"},{"key":"692_CR72","doi-asserted-by":"publisher","first-page":"519","DOI":"10.1038\/nature03566","volume":"435","author":"B Gigant","year":"2005","unstructured":"Gigant B, Wang C, Ravelli RBG et al (2005) Structural basis for the regulation of tubulin by vinblastine. Nature 435:519\u2013522. https:\/\/doi.org\/10.1038\/nature03566","journal-title":"Nature"},{"key":"692_CR73","doi-asserted-by":"publisher","first-page":"10595","DOI":"10.1021\/bi701147f","volume":"46","author":"C Wang","year":"2007","unstructured":"Wang C, Cormier A, Gigant B, Knossow M (2007) Insight into the GTPase activity of tubulin from complexes with stathmin-like domains. Biochemistry 46:10595\u201310602. https:\/\/doi.org\/10.1021\/bi701147f","journal-title":"Biochemistry"},{"key":"692_CR74","doi-asserted-by":"publisher","first-page":"1043","DOI":"10.1080\/00498250400015285","volume":"34","author":"L Mottier","year":"2004","unstructured":"Mottier L, Virkel G, Solana H et al (2004) Triclabendazole biotransformation and comparative diffusion of the parent drug and its oxidized metabolites into Fasciola hepatica. Xenobiotica 34:1043\u20131057. https:\/\/doi.org\/10.1080\/00498250400015285","journal-title":"Xenobiotica"}],"container-title":["Acta Parasitologica"],"original-title":[],"language":"en","link":[{"URL":"https:\/\/link.springer.com\/content\/pdf\/10.1007\/s11686-023-00692-z.pdf","content-type":"application\/pdf","content-version":"vor","intended-application":"text-mining"},{"URL":"https:\/\/link.springer.com\/article\/10.1007\/s11686-023-00692-z\/fulltext.html","content-type":"text\/html","content-version":"vor","intended-application":"text-mining"},{"URL":"https:\/\/link.springer.com\/content\/pdf\/10.1007\/s11686-023-00692-z.pdf","content-type":"application\/pdf","content-version":"vor","intended-application":"similarity-checking"}],"deposited":{"date-parts":[[2023,12,15]],"date-time":"2023-12-15T08:33:35Z","timestamp":1702629215000},"score":1,"resource":{"primary":{"URL":"https:\/\/link.springer.com\/10.1007\/s11686-023-00692-z"}},"subtitle":[],"short-title":[],"issued":{"date-parts":[[2023,6,18]]},"references-count":74,"journal-issue":{"issue":"3","published-print":{"date-parts":[[2023,9]]}},"alternative-id":["692"],"URL":"https:\/\/doi.org\/10.1007\/s11686-023-00692-z","relation":{},"ISSN":["1230-2821","1896-1851"],"issn-type":[{"value":"1230-2821","type":"print"},{"value":"1896-1851","type":"electronic"}],"subject":[],"published":{"date-parts":[[2023,6,18]]},"assertion":[{"value":"16 June 2022","order":1,"name":"received","label":"Received","group":{"name":"ArticleHistory","label":"Article History"}},{"value":"29 May 2023","order":2,"name":"accepted","label":"Accepted","group":{"name":"ArticleHistory","label":"Article History"}},{"value":"18 June 2023","order":3,"name":"first_online","label":"First Online","group":{"name":"ArticleHistory","label":"Article History"}},{"order":1,"name":"Ethics","group":{"name":"EthicsHeading","label":"Declarations"}},{"value":"The authors declare that they have no conflicts of interest.","order":2,"name":"Ethics","group":{"name":"EthicsHeading","label":"Conflict of Interest"}},{"value":"This study did not involve human or animal experimentation.","order":3,"name":"Ethics","group":{"name":"EthicsHeading","label":"Ethics Approval"}}]}}