Abdelmalek L, Fatiha M, Leila N, Mouna C, Nora M, Djameleddine K (2016) Computational study of inclusion complex formation between carvacrol and β-cyclodextrin in vacuum and in water: charge transfer, electronic transitions and NBO analysis. J Mol Liq 224:62–71. https://doi.org/10.1016/j.molliq.2016.09.053
Abraham MJ, Murtola T, Schulz R, Páll S, Smith JC, Hess B, Lindahl E (2015) GROMACS: high performance molecular simulations through multi-level parallelism from laptops to supercomputers. SoftwareX 1–2:19–25. https://doi.org/10.1016/j.softx.2015.06.001
Almeida JSFD, Botelho FD, Souza FR, Santos MC, Gonçalves AS, Rodrigues RLB, Cardozo M, Kitawaga DAS, Vieira LA, Silva RSF, Cavalcante SFA, Bastos LC, Nogueira MOT, Santana PIR, Brum JOC, Nepovimova E, Kuca K, LaPlante SR, Galante EBF, França TCC (2022) Searching for potential drugs against SARS-CoV-2 through virtual screening on several molecular targets. J Biomol Struct Dyn 40:5229–5242. https://doi.org/10.1080/07391102.2020.1869096
Article CAS PubMed Google Scholar
Alvarez L, Moreno G, Moreno L, Ceballos L, Shaw L, Fairweather I, Lanusse C (2009) Comparative assessment of albendazole and triclabendazole ovicidal activity on Fasciola hepatica eggs. Vet Parasitol 164:211–216. https://doi.org/10.1016/j.vetpar.2009.05.014
Article CAS PubMed Google Scholar
Antonioli G, Fontanella G, Echeverrigaray S, Delamare APL, Pauletti GF, Barcellos T (2020) Poly (lactic acid) nanocapsules containing lemongrass volatile oil for postharvest decay control: in vitro and in vivo evaluation against phytopathogenic fungi. Food Chem 326:126997. https://doi.org/10.1016/j.foodchem.2020.126997
Article CAS PubMed Google Scholar
Babaoglu HC, Bayrak A Ozdemir, N Ozgun, N (2017) Encapsulation of clove volatile oil in hydroxypropyl betacyclodextrin for characterization, controlled release, and antioxidant activity. J Food Process Pres 41:e13202. https://doi.org/10.1111/jfpp.13202
Barbieri N, Sanchez-Contreras A, Canto A, Cauich-Rodriguez JV, Vargas-Coronado R, Calvo-Irabien LM (2018) Effect of cyclodextrins and Mexican oregano (Lippia graveolens Kunth) chemotypes on the microencapsulation of volatile oil. Ind Crops Prod 121:114–123. https://doi.org/10.1016/j.indcrop.2018.04.081
Berman HM, Westbrook J, Feng Z, Gilliland G, Bhat TN, Weissig H, Shindyalov IN, Bourne PE (2000) The Protein Data Bank. Nucleic Acids Res 28:235–242. https://doi.org/10.1093/nar/28.1.235
Article CAS PubMed PubMed Central Google Scholar
Botelho FD, Santos MC, Gonçalve AS, Kuca K, Valis M, LaPlante SR, França TCC, Almeida JSFD (2020) Ligand-based virtual screening, molecular docking, molecular dynamics, and MM-PBSA calculations towards the identification of potential novel ricin inhibitors. Toxins 12:746. https://doi.org/10.3390/toxins12120746
Article CAS PubMed PubMed Central Google Scholar
Brewster ME, Loftsson T (2007) Cyclodextrins as pharmaceutical solubilizers. Adv Drug Deliv Rev 59:645–666. https://doi.org/10.1016/j.addr.2007.05.012
Article CAS PubMed Google Scholar
Castro LSEP, Pieters W, Alemdehy MF, Aslam MA, Buoninfante OA, Raaijmakers JA, Pilzecker B, Van den Berk PCM, Riele H, Medema RH, Pedrosa RC, Jacobs H (2021a) The widely used antihelmintic drug albendazole is a potent inducer of loss of heterozygosity. Front Pharmacol 12:e596535. https://doi.org/10.3389/fphar.2021.596535
Castro JC, Pante GC, Souza DS, Pires TY, Miyoshi JH, Garcia FP, Nakamura CV, Mulati ACN, Mossini SAG, Machinski-Junior M, Matioli G (2022) Molecular inclusion of Cymbopogon martinii essential oil with β-cyclodextrin as a strategy to stabilize and increase its bioactivity. Food Hydrocoll Hlth 2:100066. https://doi.org/10.1016/j.fhfh.2022.100066
De Castro LM, Pinto NB, Castro LLD, Moura MQ, Mota TO, Madrid IM, Freitag RA, Berne MEA (2017) Atividade ovicida do óleo essencial e do extrato hidroalcoólico de Ocimum basilicum sobre nematódeos gastrintestinais de ovinos. Sci Anim Health 5:138–150. https://doi.org/10.15210/sah.v5i2.10726
De Castro LM, Pinto NB, Moura MQ, Freitag RA, Capella GA, Motta TO, Villela MM, Berne MEA (2021) In vitro activity of the essential oil of Cuminum cyminum against Haemonchus contortus of sheep. Braz J Dev 7:44079–44091. https://doi.org/10.34117/bjdv7n5-025
Chambers E, Ryan LA, Hoey EM, Trudgett A, McFerran NV, Fairweather I, Timson DJ (2010) Liver fluke β-tubulin isotype 2 binds albendazole and is thus a probable target of this drug. Parasitol Res 107:1257–1264. https://doi.org/10.1007/s00436-010-1997-5
Cid-Samamed A, Rakmai J, Mejuto JC, Simal-Gandara J, Astray G (2022) Cyclodextrins inclusion complex: preparation methods, analytical techniques and food industry applications. Food Chem 384:132467. https://doi.org/10.1016/j.foodchem.2022.132467
Costa AV, Almeida BR, Gonçalves LV, Crico KB, Ignacchiti MDC, Pereira Junior OS, Pinheiro PF, Queiroz VT (2015) Molluscicidal effect of essential oil of Cymbopogon winterianus Jowitt (Poaceae) on Lymnaea columella (Say, 1817) and Biomphalaria tenagophila (D’Orbigny, 1835). Rev Bras Pl Med 17:707–712. https://doi.org/10.1590/1983-084X/14_017
Cwiklinski K, O'neill SM, Donnelly S, Dalton JP (2016) A prospective view of animal and human fasciolosis. Parasite Immunol 38:558–568. https://doi.org/10.1111/pim.12343
Fairweather I, McShane DD, Shaw L, Ellison SE, O’Hagan NT, York EA, Trudgett A, Brennan GP (2012) Development of an egg hatch assay for the diagnosis of triclabendazole resistance in Fasciola hepatica: proof of concept. Vet Parasitol 183:249–259. https://doi.org/10.1016/j.vetpar.2011.07.023
Article CAS PubMed Google Scholar
Fairweather I, Brennan GP, Hanna REB, Robinson MW, Skuce PJ (2020) Drug resistance in liver flukes. Int J Parasitol Drugs Drug Resist 12:39–59. https://doi.org/10.1016/j.ijpddr.2019.11.003
Article CAS PubMed PubMed Central Google Scholar
Gong HY, Liu WH, Lv GY, Zhou X (2014) Analysis of essential oils of Origanum vulgare from six production areas of China and Pakistan. Rev Bras Farmacogn 24:25–32. https://doi.org/10.1590/0102-695X2014241434
Hanna REB, Fairweather I, Robinson MW (2021) The reproductive system of Fasciola hepatica. In: Dalton JP (ed) Fasciolosis, Wallingford UK, CABI, pp 112–144. https://doi.org/10.1079/9781789246162.0004
Hassinen T, Peräkylä M (2001) New energy terms for reduced protein models implemented in an off-lattice force field. J Comput Chem 22:1229–1242. https://doi.org/10.1002/jcc.1080
Herrera A, Rodríguez FJ, Bruna JE, Abarca RL, Galotto MJ, Guarda A, Mascayano C, Sandoval-Yáñez C, Padula M, Felipe FRS (2019) Antifungal and physicochemical properties of inclusion complexes based on β-cyclodextrin and essential oil derivatives. Food Res Int 121:127–135. https://doi.org/10.1016/j.foodres.2019.03.026
Article CAS PubMed Google Scholar
Hussein ANA, Hassan IM, Khalifa RMA (2010) Development and hatching mechanism of Fasciola eggs, light and scanning electron microscopic studies. Saudi J Biol Sc 17:247–251. 10.1016%2Fj.sjbs.2010.04.010
Ishwarya SP, Anandharamakrishnan C, Stapley AG (2015) Spray-freeze-drying: a novel process for the drying of foods and bioproducts. Trends Food Sci Technol 41:161–181. https://doi.org/10.1016/j.tifs.2014.10.008
Ju J, Xie Y, Yu H, Guo Y, Cheng Y, Qian H, Yao W (2022) Synergistic interactions of plant essential oils with antimicrobial agents: a new antimicrobial therapy. Crit Rev Food Sci Nutr 62:1740–1751. https://doi.org/10.1080/10408398.2020.1846494
Article CAS PubMed Google Scholar
Jug M (2020) Cyclodextrin-based drug delivery systems. In: Pippa N, Demetzos C (eds ) Nanomaterials for clinical applications. Elsevier, Amsterdam, The Netherlands, pp 29–69. https://doi.org/10.1016/B978-0-12-816705-2.00002-3
Kamimura JA, Santos EH, Hill LE, Gomes CL (2014) Antimicrobial and antioxidant activities of carvacrol microencapsulated in hydroxypropyl-beta-cyclodextrin. LWT Food Sci Technol 57:701–709. https://doi.org/10.1016/j.lwt.2014.02.014
Kayaci F, Sen HS, Durgun E, Uyar T (2014) Functional electrospun polymeric nanofibers incorporating geraniol–cyclodextrin inclusion complexes: high thermal stability and enhanced durability of geraniol. Food Res Int 62:424–431. https://doi.org/10.1016/j.foodres.2014.03.033
Khan M, Khan ST, Khan NA, Mahmood A, Al-Kedhairy AA, Alkhathlan HZ (2018) The composition of the essential oil and aqueous distillate of Origanum vulgare L. growing in Saudi Arabia and evaluation of their antibacterial activity. Arab J Chem 11:1189–1200. https://doi.org/10.1016/j.arabjc.2018.02.008
Kotronia M, Kavetsou E, Loupassaki S, Kikionis S, Vouyiouka S, Detsi A (2017). Encapsulation of oregano (Origanum onites L.) essential oil in β-cyclodextrin (β-CD): synthesis and characterization of the inclusion complexes. Bioengineering 4:74. https://doi.org/10.3390/bioengineering4030074
Kumari R, Kumar R, Lynn A (2014) g_mmpbsa—a GROMACS tool for high-throughput MM-PBSA calculations. J Chem Inf Model 54:1951–1962. https://doi.org/10.1021/ci500020m
Article CAS PubMed Google Scholar
Liang J, Zhang Y, Chi P, Liu H, Jing Z, Cao H, Du Y, Zhao Y, Qin X, Zhang W, Kong D (2023) Essential oils: chemical constituents, potential neuropharmacological effects and aromatherapy- a review. Pharmacol Res Mod Chin Med 6:100210. https://doi.org/10.1016/j.prmcm.2022.100210
Liu HN, Jiang XX, Naeem A, Chen FC, Wang L, Liu YX, Li Z, Ming LS (2023) Fabrication and characterization of β-cyclodextrin/Mosla chinensis essential oil inclusion complexes: experimental design and molecular modeling. Molecules 28:37. https://doi.org/10.3390/molecules28010037
Marques CSF, Barreto NS, Oliveira SSC, Santos ALS, Branquinha MH, Sousa DP, Castro M, Andrade LN, Pereira MM, Silva CF, Chaud MV, Jain S, Fricks AT, Souto EB, Severino P (2020a) β-cyclodextrin/isopentyl caffeate inclusion complex: synthesis, characterization and antileishmanial activity. Molecules 25:4181. https://doi.org/10.3390/molecules25184181
Comments (0)