{"status":"ok","message-type":"work","message-version":"1.0.0","message":{"indexed":{"date-parts":[[2026,3,10]],"date-time":"2026-03-10T20:10:10Z","timestamp":1773173410410,"version":"3.50.1"},"reference-count":53,"publisher":"Elsevier BV","license":[{"start":{"date-parts":[[2021,3,1]],"date-time":"2021-03-01T00:00:00Z","timestamp":1614556800000},"content-version":"tdm","delay-in-days":0,"URL":"https:\/\/www.elsevier.com\/tdm\/userlicense\/1.0\/"},{"start":{"date-parts":[[2021,3,1]],"date-time":"2021-03-01T00:00:00Z","timestamp":1614556800000},"content-version":"tdm","delay-in-days":0,"URL":"https:\/\/www.elsevier.com\/legal\/tdmrep-license"}],"funder":[{"name":"Department of Biotechnology and Genetic Engineering"},{"name":"Faculty of Life Science"},{"name":"Mawlana Bhashani Science and Technology University"}],"content-domain":{"domain":["elsevier.com","sciencedirect.com"],"crossmark-restriction":true},"short-container-title":["Infection, Genetics and Evolution"],"published-print":{"date-parts":[[2021,3]]},"DOI":"10.1016\/j.meegid.2020.104699","type":"journal-article","created":{"date-parts":[[2020,12,29]],"date-time":"2020-12-29T21:59:01Z","timestamp":1609279141000},"page":"104699","update-policy":"https:\/\/doi.org\/10.1016\/elsevier_cm_policy","source":"Crossref","is-referenced-by-count":4,"special_numbering":"C","title":["Pharmacoinformatics based elucidation and designing of potential inhibitors against Plasmodium falciparum to target importin \u03b1\/\u03b2 mediated nuclear importation"],"prefix":"10.1016","volume":"88","author":[{"given":"Arafat Rahman","family":"Oany","sequence":"first","affiliation":[],"role":[{"role":"author","vocabulary":"crossref"}]},{"given":"Tahmina","family":"Pervin","sequence":"additional","affiliation":[],"role":[{"role":"author","vocabulary":"crossref"}]},{"given":"Mohammad Ali","family":"Moni","sequence":"additional","affiliation":[],"role":[{"role":"author","vocabulary":"crossref"}]}],"member":"78","reference":[{"issue":"17","key":"10.1016\/j.meegid.2020.104699_bb0005","doi-asserted-by":"crossref","first-page":"8650","DOI":"10.1128\/JVI.00508-10","article-title":"Importin \u03b13 interacts with HIV-1 integrase and contributes to HIV-1 nuclear import and replication","volume":"84","author":"Ao","year":"2010","journal-title":"J. Virol."},{"issue":"2","key":"10.1016\/j.meegid.2020.104699_bb0010","doi-asserted-by":"crossref","first-page":"195","DOI":"10.1093\/bioinformatics\/bti770","article-title":"The SWISS-MODEL workspace: a web-based environment for protein structure homology modelling","volume":"22","author":"Arnold","year":"2006","journal-title":"Bioinformatics"},{"issue":"5","key":"10.1016\/j.meegid.2020.104699_bb0015","doi-asserted-by":"crossref","first-page":"411","DOI":"10.1056\/NEJMoa1314981","article-title":"Spread of artemisinin resistance in Plasmodium falciparum malaria","volume":"371","author":"Ashley","year":"2014","journal-title":"N. Engl. J. Med."},{"issue":"4","key":"10.1016\/j.meegid.2020.104699_bb0020","doi-asserted-by":"crossref","first-page":"564","DOI":"10.1128\/CMR.15.4.564-594.2002","article-title":"Evolutionary and historical aspects of the burden of malaria","volume":"15","author":"Carter","year":"2002","journal-title":"Clin. Microbiol. Rev."},{"issue":"1","key":"10.1016\/j.meegid.2020.104699_bb0025","doi-asserted-by":"crossref","first-page":"153","DOI":"10.1186\/1475-2875-12-153","article-title":"Ivermectin to reduce malaria transmission: a research agenda for a promising new tool for elimination","volume":"12","author":"Chaccour","year":"2013","journal-title":"Malar. J."},{"key":"10.1016\/j.meegid.2020.104699_bb0030","series-title":"admetSAR: A Comprehensive Source and Free Tool for Assessment of Chemical ADMET Properties","first-page":"3099","author":"Cheng","year":"2012"},{"issue":"1","key":"10.1016\/j.meegid.2020.104699_bb0035","doi-asserted-by":"crossref","first-page":"1","DOI":"10.1038\/s41598-020-61181-1","article-title":"Structural and evolutionary analyses of the Plasmodium falciparum chloroquine resistance transporter","volume":"10","author":"Copp\u00e9e","year":"2020","journal-title":"Sci. Rep."},{"issue":"10","key":"10.1016\/j.meegid.2020.104699_bb0040","doi-asserted-by":"crossref","first-page":"1695","DOI":"10.1093\/bioinformatics\/btv010","article-title":"ADME SARfari: comparative genomics of drug metabolizing systems","volume":"31","author":"Davies","year":"2015","journal-title":"Bioinformatics"},{"key":"10.1016\/j.meegid.2020.104699_bb0045","series-title":"The PyMOL molecular graphics system","author":"De Lano","year":"2002"},{"issue":"3","key":"10.1016\/j.meegid.2020.104699_bb0050","doi-asserted-by":"crossref","first-page":"1792","DOI":"10.1016\/j.bbrc.2018.07.115","article-title":"Molecular basis for the lack of auto-inhibition of Plasmodium falciparum importin \u03b1","volume":"503","author":"Dey","year":"2018","journal-title":"Biochem. Biophys. Res. Commun."},{"issue":"Suppl_2","key":"10.1016\/j.meegid.2020.104699_bb0055","doi-asserted-by":"crossref","first-page":"W116","DOI":"10.1093\/nar\/gkl282","article-title":"CASTp: computed atlas of surface topography of proteins with structural and topographical mapping of functionally annotated residues","volume":"34","author":"Dundas","year":"2006","journal-title":"Nucleic Acids Res."},{"issue":"5","key":"10.1016\/j.meegid.2020.104699_bb0060","doi-asserted-by":"crossref","first-page":"1183","DOI":"10.1006\/jmbi.2000.3642","article-title":"Structural basis of recognition of monopartite and bipartite nuclear localization sequences by mammalian importin-\u03b1","volume":"297","author":"Fontes","year":"2000","journal-title":"J. Molecular Biol."},{"issue":"1","key":"10.1016\/j.meegid.2020.104699_bb0065","doi-asserted-by":"crossref","first-page":"607","DOI":"10.1146\/annurev.cellbio.15.1.607","article-title":"Transport between the cell nucleus and the cytoplasm","volume":"15","author":"G\u00f6rlich","year":"1999","journal-title":"Annu. Rev. Cell Dev. Bi."},{"issue":"3","key":"10.1016\/j.meegid.2020.104699_bb0070","article-title":"Comparative structure analysis of tyramine-\u03b2-hydroxylase from fruit fly and ADME\/T-based profiling of 1-arylimidazole-2 (3H)-thiones as potential inhibitors","volume":"4","author":"Hasan","year":"2016","journal-title":"Int. J. Anal. Bio. Sci."},{"issue":"1","key":"10.1016\/j.meegid.2020.104699_bb0075","doi-asserted-by":"crossref","first-page":"253","DOI":"10.1002\/dvdy.20569","article-title":"Importin \u03b1 mRNAs have distinct expression profiles during spermatogenesis","volume":"235","author":"Hogarth","year":"2006","journal-title":"Developmental dynamics: an official publication of the American Association of Anatomists"},{"key":"10.1016\/j.meegid.2020.104699_bb0080","doi-asserted-by":"crossref","first-page":"29","DOI":"10.1016\/j.compbiolchem.2016.10.002","article-title":"Identification of potential inhibitor and enzyme-inhibitor complex on trypanothione reductase to control Chagas disease","volume":"65","author":"Hossain","year":"2016","journal-title":"Comput. Biol. Chem."},{"issue":"1","key":"10.1016\/j.meegid.2020.104699_bb0085","doi-asserted-by":"crossref","first-page":"1","DOI":"10.1186\/1758-2946-1-20","article-title":"The PubChem chemical structure sketcher","volume":"1","author":"Ihlenfeldt","year":"2009","journal-title":"J. Cheminformatics"},{"issue":"11","key":"10.1016\/j.meegid.2020.104699_bb0090","doi-asserted-by":"crossref","first-page":"1859","DOI":"10.1002\/jcc.20945","article-title":"CHARMM-GUI: a web-based graphical user interface for CHARMM","volume":"29","author":"Jo","year":"2008","journal-title":"J. Comput. Chem."},{"issue":"D1","key":"10.1016\/j.meegid.2020.104699_bb0095","doi-asserted-by":"crossref","first-page":"D1202","DOI":"10.1093\/nar\/gkv951","article-title":"PubChem substance and compound databases","volume":"44","author":"Kim","year":"2016","journal-title":"Nucleic Acids Res."},{"issue":"W1","key":"10.1016\/j.meegid.2020.104699_bb0100","doi-asserted-by":"crossref","first-page":"W294","DOI":"10.1093\/nar\/gks493","article-title":"GalaxyWEB server for protein structure prediction and refinement","volume":"40","author":"Ko","year":"2012","journal-title":"Nucleic Acids Res."},{"issue":"2","key":"10.1016\/j.meegid.2020.104699_bb0105","doi-asserted-by":"crossref","first-page":"321","DOI":"10.1016\/S0014-4827(03)00100-9","article-title":"Ratjadones inhibit nuclear export by blocking CRM1\/exportin 1","volume":"286","author":"K\u00f6ster","year":"2003","journal-title":"Exp. Cell Res."},{"issue":"16","key":"10.1016\/j.meegid.2020.104699_bb0110","doi-asserted-by":"crossref","first-page":"9112","DOI":"10.1073\/pnas.96.16.9112","article-title":"Leptomycin B inactivates CRM1\/exportin 1 by covalent modification at a cysteine residue in the central conserved region","volume":"96","author":"Kudo","year":"1999","journal-title":"Proc. Natl. Acad. Sci."},{"issue":"4","key":"10.1016\/j.meegid.2020.104699_bb0115","doi-asserted-by":"crossref","first-page":"477","DOI":"10.1007\/BF00228148","article-title":"AQUA and PROCHECK-NMR: programs for checking the quality of protein structures solved by NMR","volume":"8","author":"Laskowski","year":"1996","journal-title":"J. Biomol. NMR"},{"issue":"4","key":"10.1016\/j.meegid.2020.104699_bb0120","doi-asserted-by":"crossref","first-page":"337","DOI":"10.1016\/j.ddtec.2004.11.007","article-title":"Lead-and drug-like compounds: the rule-of-five revolution","volume":"1","author":"Lipinski","year":"2004","journal-title":"Drug Discov. Today Technol."},{"issue":"5","key":"10.1016\/j.meegid.2020.104699_bb0125","doi-asserted-by":"crossref","first-page":"197","DOI":"10.1111\/j.1365-3024.2005.00759.x","article-title":"Identification of karyopherin \u03b2 as an immunogenic antigen of the malaria parasite using immune mice and human sera","volume":"27","author":"Mohmmed","year":"2005","journal-title":"Parasite Immunol."},{"key":"10.1016\/j.meegid.2020.104699_bb0130","doi-asserted-by":"crossref","first-page":"1139","DOI":"10.2147\/DDDT.S67861","article-title":"Design of an epitope-based peptide vaccine against spike protein of human coronavirus: an in silico approach","volume":"8","author":"Oany","year":"2014","journal-title":"Drug Des. Dev. Ther."},{"key":"10.1016\/j.meegid.2020.104699_bb0135","article-title":"An in silico approach for characterization of an aminoglycoside antibiotic-resistant methyltransferase protein from Pyrococcus furiosus (DSM 3638)","volume":"8","author":"Oany","year":"2014","journal-title":"Bioinforma. Biol. Insights"},{"key":"10.1016\/j.meegid.2020.104699_bb0140","doi-asserted-by":"crossref","DOI":"10.1155\/2017\/6412353","article-title":"Vaccinomics approach for designing potential peptide vaccine by targeting Shigella spp. serine protease autotransporter subfamily protein SigA","volume":"2017","author":"Oany","year":"2017","journal-title":"J. Immunol. Res."},{"issue":"1","key":"10.1016\/j.meegid.2020.104699_bb0145","doi-asserted-by":"crossref","first-page":"11","DOI":"10.1007\/s40203-018-0048-2","article-title":"Identification of potential drug targets and inhibitor of the pathogenic bacteria Shigella flexneri 2a through the subtractive genomic approach","volume":"6","author":"Oany","year":"2018","journal-title":"In silico Pharmacol."},{"issue":"6","key":"10.1016\/j.meegid.2020.104699_bb0150","doi-asserted-by":"crossref","first-page":"106177","DOI":"10.1016\/j.ijantimicag.2020.106177","article-title":"Design of novel viral attachment inhibitors of the spike glycoprotein (S) of severe acute respiratory syndrome coronavirus-2 (SARS-CoV-2) through virtual screening and dynamics","volume":"56","author":"Oany","year":"2020","journal-title":"Int. J. Antimicrob. Agents"},{"issue":"1","key":"10.1016\/j.meegid.2020.104699_bb0160","doi-asserted-by":"crossref","first-page":"33","DOI":"10.1186\/1758-2946-3-33","article-title":"Open Babel: An open chemical toolbox","volume":"3","author":"O'Boyle","year":"2011","journal-title":"J. Cheminformatics"},{"issue":"3","key":"10.1016\/j.meegid.2020.104699_bb0165","doi-asserted-by":"crossref","first-page":"251","DOI":"10.1023\/A:1008130001697","article-title":"Property distribution of drug-related chemical databases","volume":"14","author":"Oprea","year":"2000","journal-title":"J. Comput. Aid. Mol. Des."},{"key":"10.1016\/j.meegid.2020.104699_bb0170","unstructured":"Organisation W.H. (2018) World malaria report."},{"issue":"3","key":"10.1016\/j.meegid.2020.104699_bb0175","doi-asserted-by":"crossref","first-page":"430","DOI":"10.2165\/00003495-199345030-00009","article-title":"Mefloquine","volume":"45","author":"Palmer","year":"1993","journal-title":"Drugs"},{"issue":"1","key":"10.1016\/j.meegid.2020.104699_bb0180","doi-asserted-by":"crossref","DOI":"10.1038\/cddis.2013.521","article-title":"Plasmodium falciparum signal recognition particle components and anti-parasitic effect of ivermectin in blocking nucleo-cytoplasmic shuttling of SRP","volume":"5","author":"Panchal","year":"2014","journal-title":"Cell Death Dis."},{"issue":"6","key":"10.1016\/j.meegid.2020.104699_bb0185","doi-asserted-by":"crossref","first-page":"541","DOI":"10.1080\/00034983.1990.11812509","article-title":"The chemotherapy of rodent malaria. XLV. Reversal of chloroquine resistance in rodent and human Plasmodium by antihistaminic agents","volume":"84","author":"Peters","year":"1990","journal-title":"Ann. Trop. Med. Parasit."},{"issue":"16","key":"10.1016\/j.meegid.2020.104699_bb0190","doi-asserted-by":"crossref","first-page":"1781","DOI":"10.1002\/jcc.20289","article-title":"Scalable molecular dynamics with NAMD","volume":"26","author":"Phillips","year":"2005","journal-title":"J. Comput. Chem."},{"issue":"3","key":"10.1016\/j.meegid.2020.104699_bb0195","doi-asserted-by":"crossref","first-page":"318","DOI":"10.1002\/prot.340230306","article-title":"Evaluation of comparative protein modeling by MODELLER","volume":"23","author":"Sali","year":"1995","journal-title":"Proteins: Struct. Funct. Genet."},{"key":"10.1016\/j.meegid.2020.104699_bb0200","series-title":"OSIRIS property explorer","author":"Sander","year":"2001"},{"key":"10.1016\/j.meegid.2020.104699_bb0205","series-title":"QikProp, version 3.5","author":"Schr\u00f6dinger","year":"2012"},{"issue":"19","key":"10.1016\/j.meegid.2020.104699_bb0210","doi-asserted-by":"crossref","first-page":"3596","DOI":"10.1021\/jp984217f","article-title":"The GROMOS biomolecular simulation program package","volume":"103","author":"Scott","year":"1999","journal-title":"J. Phys. Chem. A"},{"issue":"7030","key":"10.1016\/j.meegid.2020.104699_bb0215","doi-asserted-by":"crossref","first-page":"214","DOI":"10.1038\/nature03342","article-title":"The global distribution of clinical episodes of Plasmodium falciparum malaria","volume":"434","author":"Snow","year":"2005","journal-title":"Nature"},{"issue":"5","key":"10.1016\/j.meegid.2020.104699_bb0220","doi-asserted-by":"crossref","first-page":"670","DOI":"10.1093\/infdis\/jiu491","article-title":"Independent emergence of artemisinin resistance mutations among Plasmodium falciparum in Southeast Asia","volume":"211","author":"Takala-Harrison","year":"2015","journal-title":"J. Infect. Dis."},{"issue":"2","key":"10.1016\/j.meegid.2020.104699_bb0225","doi-asserted-by":"crossref","first-page":"455","DOI":"10.1002\/jcc.21334","article-title":"AutoDock Vina: improving the speed and accuracy of docking with a new scoring function, efficient optimization, and multithreading","volume":"31","author":"Trott","year":"2010","journal-title":"J. Comput. Chem."},{"issue":"7","key":"10.1016\/j.meegid.2020.104699_bb0230","doi-asserted-by":"crossref","first-page":"1488","DOI":"10.1002\/jcc.21720","article-title":"Web servers and services for electrostatics calculations with APBS and PDB2PQR","volume":"32","author":"Unni","year":"2011","journal-title":"J. Comput. Chem."},{"issue":"2","key":"10.1016\/j.meegid.2020.104699_bb0235","doi-asserted-by":"crossref","first-page":"192","DOI":"10.1177\/1087057110390360","article-title":"An AlphaScreen\u00ae-based assay for high-throughput screening for specific inhibitors of nuclear import","volume":"16","author":"Wagstaff","year":"2011","journal-title":"J. Biomol. Screen."},{"issue":"3","key":"10.1016\/j.meegid.2020.104699_bb0240","doi-asserted-by":"crossref","first-page":"851","DOI":"10.1042\/BJ20120150","article-title":"Ivermectin is a specific inhibitor of importin \u03b1\/\u03b2-mediated nuclear import able to inhibit replication of HIV-1 and dengue virus","volume":"443","author":"Wagstaff","year":"2012","journal-title":"Biochem. J."},{"issue":"8","key":"10.1016\/j.meegid.2020.104699_bb0245","doi-asserted-by":"crossref","first-page":"461","DOI":"10.1016\/j.tcb.2010.05.001","article-title":"The Part and the Whole: functions of nucleoporins in nucleocytoplasmic transport","volume":"20","author":"W\u00e4lde","year":"2010","journal-title":"Trends Cell Biol."},{"issue":"Suppl_1","key":"10.1016\/j.meegid.2020.104699_bb0250","first-page":"D13","article-title":"Database resources of the national center for biotechnology information","volume":"36","author":"Wheeler","year":"2007"},{"issue":"Suppl_2","key":"10.1016\/j.meegid.2020.104699_bb0255","doi-asserted-by":"crossref","first-page":"W407","DOI":"10.1093\/nar\/gkm290","article-title":"ProSA-web: interactive web service for the recognition of errors in three-dimensional structures of proteins","volume":"35","author":"Wiederstein","year":"2007","journal-title":"Nucleic Acids Res."},{"issue":"D1","key":"10.1016\/j.meegid.2020.104699_bb0260","doi-asserted-by":"crossref","first-page":"D1137","DOI":"10.1093\/nar\/gks1059","article-title":"SwissBioisostere: a database of molecular replacements for ligand design","volume":"41","author":"Wirth","year":"2013","journal-title":"Nucleic Acids Res."},{"issue":"1","key":"10.1016\/j.meegid.2020.104699_bb0265","doi-asserted-by":"crossref","first-page":"1","DOI":"10.1186\/1475-2875-9-126","article-title":"A nuclear targeting system in Plasmodium falciparum","volume":"9","author":"Wittayacom","year":"2010","journal-title":"Malaria J."},{"issue":"1","key":"10.1016\/j.meegid.2020.104699_bb0270","first-page":"422","article-title":"Shuttling imbalance of MLF1 results in p53 instability and increases susceptibility to oncogenic transformation","volume":"28","author":"Yoneda-Kato","year":"2008"}],"container-title":["Infection, Genetics and Evolution"],"original-title":[],"language":"en","link":[{"URL":"https:\/\/api.elsevier.com\/content\/article\/PII:S156713482030530X?httpAccept=text\/xml","content-type":"text\/xml","content-version":"vor","intended-application":"text-mining"},{"URL":"https:\/\/api.elsevier.com\/content\/article\/PII:S156713482030530X?httpAccept=text\/plain","content-type":"text\/plain","content-version":"vor","intended-application":"text-mining"}],"deposited":{"date-parts":[[2025,10,27]],"date-time":"2025-10-27T14:45:33Z","timestamp":1761576333000},"score":1,"resource":{"primary":{"URL":"https:\/\/linkinghub.elsevier.com\/retrieve\/pii\/S156713482030530X"}},"subtitle":[],"short-title":[],"issued":{"date-parts":[[2021,3]]},"references-count":53,"alternative-id":["S156713482030530X"],"URL":"https:\/\/doi.org\/10.1016\/j.meegid.2020.104699","relation":{"has-preprint":[{"id-type":"doi","id":"10.1101\/2020.12.29.424688","asserted-by":"object"}]},"ISSN":["1567-1348"],"issn-type":[{"value":"1567-1348","type":"print"}],"subject":[],"published":{"date-parts":[[2021,3]]},"assertion":[{"value":"Elsevier","name":"publisher","label":"This article is maintained by"},{"value":"Pharmacoinformatics based elucidation and designing of potential inhibitors against Plasmodium falciparum to target importin \u03b1\/\u03b2 mediated nuclear importation","name":"articletitle","label":"Article Title"},{"value":"Infection, Genetics and Evolution","name":"journaltitle","label":"Journal Title"},{"value":"https:\/\/doi.org\/10.1016\/j.meegid.2020.104699","name":"articlelink","label":"CrossRef DOI link to publisher maintained version"},{"value":"article","name":"content_type","label":"Content Type"},{"value":"\u00a9 2020 Elsevier B.V. All rights reserved.","name":"copyright","label":"Copyright"}],"article-number":"104699"}}