{"id":"https://openalex.org/W4285453752","doi":"https://doi.org/10.1166/jctn.2021.9726","title":"An In Silico and In Vitro Study of the Metal Complex di-\u03bc-Chloro-Bis[Chlorine (4,7-Dimethyl-1,10-Phenanthroline) Cadmium(ii)] with Antibacterial Potential","display_name":"An In Silico and In Vitro Study of the Metal Complex di-\u03bc-Chloro-Bis[Chlorine (4,7-Dimethyl-1,10-Phenanthroline) Cadmium(ii)] with Antibacterial Potential","publication_year":2021,"publication_date":"2021-06-01","ids":{"openalex":"https://openalex.org/W4285453752","doi":"https://doi.org/10.1166/jctn.2021.9726"},"language":"en","primary_location":{"id":"doi:10.1166/jctn.2021.9726","doi":"https://doi.org/10.1166/jctn.2021.9726","is_oa":false,"landing_page_url":"https://doi.org/10.1166/jctn.2021.9726","pdf_url":null,"source":{"id":"https://openalex.org/S6195976","display_name":"Journal of Computational and Theoretical Nanoscience","issn_l":"1546-1955","issn":["1546-1955","1546-1963"],"is_oa":false,"is_in_doaj":false,"is_core":true,"listed_in":["anvur-scientific","cwts-core","poland-20","russia-white-list-3"],"host_organization":"https://openalex.org/P4310321646","host_organization_name":"American Scientific Publishers","host_organization_lineage":["https://openalex.org/P4310321646"],"host_organization_lineage_names":["American Scientific Publishers"],"type":"journal"},"license":null,"license_id":null,"version":"publishedVersion","is_accepted":true,"is_published":true,"raw_source_name":"Journal of Computational and Theoretical Nanoscience","raw_type":"journal-article"},"volume":null,"type":"article","is_traditional":true,"indexed_in":["crossref"],"open_access":{"is_oa":false,"oa_status":"closed","oa_url":null,"any_repository_has_fulltext":false},"authorships":[{"author_position":"first","author":{"id":"https://openalex.org/A5027005360","display_name":"Ruan Sousa Bastos","orcid":"https://orcid.org/0000-0003-3585-1596","observed_orcids":["https://orcid.org/0000-0003-3585-1596"]},"institutions":[{"id":"https://openalex.org/I59606676","display_name":"Universidade Federal do Par\u00e1","ror":"https://ror.org/03q9sr818","country_code":"BR","type":"education","lineage":["https://openalex.org/I59606676"]}],"countries":["BR"],"is_corresponding":false,"raw_author_name":"Ruan S. Bastos","raw_affiliation_strings":["Graduate Program in Medicinal Chemistry and Molecular Modeling, Federal University of Par\u00e1, Bel\u00e9m, PA, 66075-110, Brazil"],"raw_orcid":null,"affiliations":[{"raw_affiliation_string":"Graduate Program in Medicinal Chemistry and Molecular Modeling, Federal University of Par\u00e1, Bel\u00e9m, PA, 66075-110, Brazil","institution_ids":["https://openalex.org/I59606676"]}]},{"author_position":"middle","author":{"id":"https://openalex.org/A5026360059","display_name":"Joabe Lima Ara\u00fajo","orcid":"https://orcid.org/0000-0002-4806-9192","observed_orcids":["https://orcid.org/0000-0002-4806-9192"]},"institutions":[{"id":"https://openalex.org/I47327664","display_name":"Universidade Federal do Maranh\u00e3o","ror":"https://ror.org/043fhe951","country_code":"BR","type":"education","lineage":["https://openalex.org/I47327664"]}],"countries":["BR"],"is_corresponding":false,"raw_author_name":"Joabe L. Ara\u00fajo","raw_affiliation_strings":["Research Group in Medicinal Chemistry and Biotechnology, QUIMEBIO, Federal University of Maranh\u00e3o, S\u00e3o Bernardo, MA, 65550-000, Brazil"],"raw_orcid":null,"affiliations":[{"raw_affiliation_string":"Research Group in Medicinal Chemistry and Biotechnology, QUIMEBIO, Federal University of Maranh\u00e3o, S\u00e3o Bernardo, MA, 65550-000, Brazil","institution_ids":["https://openalex.org/I47327664"]}]},{"author_position":"middle","author":{"id":"https://openalex.org/A5101180844","display_name":"Maria L. A. S. Ferreira","orcid":null,"observed_orcids":[]},"institutions":[{"id":"https://openalex.org/I47327664","display_name":"Universidade Federal do Maranh\u00e3o","ror":"https://ror.org/043fhe951","country_code":"BR","type":"education","lineage":["https://openalex.org/I47327664"]}],"countries":["BR"],"is_corresponding":false,"raw_author_name":"Maria L. A. S. Ferreira","raw_affiliation_strings":["Research Group in Natural Sciences and Biotechnology, CIENATEC, Federal University of Maranh\u00e3o, Graja\u00fa, MA, 65940-000, Brazil"],"raw_orcid":null,"affiliations":[{"raw_affiliation_string":"Research Group in Natural Sciences and Biotechnology, CIENATEC, Federal University of Maranh\u00e3o, Graja\u00fa, MA, 65940-000, Brazil","institution_ids":["https://openalex.org/I47327664"]}]},{"author_position":"middle","author":{"id":"https://openalex.org/A5043644030","display_name":"Gleidiany da Costa Moreira","orcid":"https://orcid.org/0000-0002-2188-6352","observed_orcids":["https://orcid.org/0000-0002-2188-6352"]},"institutions":[{"id":"https://openalex.org/I47327664","display_name":"Universidade Federal do Maranh\u00e3o","ror":"https://ror.org/043fhe951","country_code":"BR","type":"education","lineage":["https://openalex.org/I47327664"]}],"countries":["BR"],"is_corresponding":false,"raw_author_name":"Gleidiany C. Moreira","raw_affiliation_strings":["Research Group in Natural Sciences and Biotechnology, CIENATEC, Federal University of Maranh\u00e3o, Graja\u00fa, MA, 65940-000, Brazil"],"raw_orcid":null,"affiliations":[{"raw_affiliation_string":"Research Group in Natural Sciences and Biotechnology, CIENATEC, Federal University of Maranh\u00e3o, Graja\u00fa, MA, 65940-000, Brazil","institution_ids":["https://openalex.org/I47327664"]}]},{"author_position":"middle","author":{"id":"https://openalex.org/A5112209336","display_name":"Francisco C. A. Lima","orcid":"https://orcid.org/0000-0002-0447-4911","observed_orcids":["https://orcid.org/0000-0002-0447-4911"]},"institutions":[],"countries":[],"is_corresponding":false,"raw_author_name":"Francisco C. A. Lima","raw_affiliation_strings":["Computational Quantum & Drug Planning Laboratory, Department of Chemistry, Teresina, PI, 64002-150, Brazil"],"raw_orcid":null,"affiliations":[{"raw_affiliation_string":"Computational Quantum & Drug Planning Laboratory, Department of Chemistry, Teresina, PI, 64002-150, Brazil","institution_ids":[]}]},{"author_position":"middle","author":{"id":"https://openalex.org/A5055979481","display_name":"Benedicto Augusto Vieira Lima","orcid":"https://orcid.org/0000-0003-3642-7201","observed_orcids":["https://orcid.org/0000-0003-3642-7201"]},"institutions":[{"id":"https://openalex.org/I47327664","display_name":"Universidade Federal do Maranh\u00e3o","ror":"https://ror.org/043fhe951","country_code":"BR","type":"education","lineage":["https://openalex.org/I47327664"]}],"countries":["BR"],"is_corresponding":false,"raw_author_name":"Benedicto A. V. Lima","raw_affiliation_strings":["Research Group in Natural Sciences and Biotechnology, CIENATEC, Federal University of Maranh\u00e3o, Graja\u00fa, MA, 65940-000, Brazil"],"raw_orcid":null,"affiliations":[{"raw_affiliation_string":"Research Group in Natural Sciences and Biotechnology, CIENATEC, Federal University of Maranh\u00e3o, Graja\u00fa, MA, 65940-000, Brazil","institution_ids":["https://openalex.org/I47327664"]}]},{"author_position":"middle","author":{"id":"https://openalex.org/A5077576740","display_name":"Igor Victor Ferreira dos Santos","orcid":null,"observed_orcids":[]},"institutions":[{"id":"https://openalex.org/I4210135412","display_name":"Universidade Federal do Amap\u00e1","ror":"https://ror.org/031va9m79","country_code":"BR","type":"education","lineage":["https://openalex.org/I4210135412"]}],"countries":["BR"],"is_corresponding":false,"raw_author_name":"Igor V. F. Santos","raw_affiliation_strings":["Laboratory of Modeling and Computational Chemistry, Department of Biological and Health Sciences, Federal University of Amap\u00e1, Macap\u00e1, AP, 68903-419, Brazil"],"raw_orcid":null,"affiliations":[{"raw_affiliation_string":"Laboratory of Modeling and Computational Chemistry, Department of Biological and Health Sciences, Federal University of Amap\u00e1, Macap\u00e1, AP, 68903-419, Brazil","institution_ids":["https://openalex.org/I4210135412"]}]},{"author_position":"middle","author":{"id":"https://openalex.org/A5091899239","display_name":"Vitor H. S. Sanches","orcid":null,"observed_orcids":[]},"institutions":[{"id":"https://openalex.org/I4210135412","display_name":"Universidade Federal do Amap\u00e1","ror":"https://ror.org/031va9m79","country_code":"BR","type":"education","lineage":["https://openalex.org/I4210135412"]}],"countries":["BR"],"is_corresponding":false,"raw_author_name":"Vitor H. S. Sanches","raw_affiliation_strings":["Laboratory of Modeling and Computational Chemistry, Department of Biological and Health Sciences, Federal University of Amap\u00e1, Macap\u00e1, AP, 68903-419, Brazil"],"raw_orcid":null,"affiliations":[{"raw_affiliation_string":"Laboratory of Modeling and Computational Chemistry, Department of Biological and Health Sciences, Federal University of Amap\u00e1, Macap\u00e1, AP, 68903-419, Brazil","institution_ids":["https://openalex.org/I4210135412"]}]},{"author_position":"middle","author":{"id":"https://openalex.org/A5026730228","display_name":"Ryan da Silva Ramos","orcid":"https://orcid.org/0000-0003-1802-1320","observed_orcids":["https://orcid.org/0000-0003-1802-1320"]},"institutions":[{"id":"https://openalex.org/I4210135412","display_name":"Universidade Federal do Amap\u00e1","ror":"https://ror.org/031va9m79","country_code":"BR","type":"education","lineage":["https://openalex.org/I4210135412"]}],"countries":["BR"],"is_corresponding":false,"raw_author_name":"Ryan S. Ramos","raw_affiliation_strings":["Laboratory of Modeling and Computational Chemistry, Department of Biological and Health Sciences, Federal University of Amap\u00e1, Macap\u00e1, AP, 68903-419, Brazil"],"raw_orcid":null,"affiliations":[{"raw_affiliation_string":"Laboratory of Modeling and Computational Chemistry, Department of Biological and Health Sciences, Federal University of Amap\u00e1, Macap\u00e1, AP, 68903-419, Brazil","institution_ids":["https://openalex.org/I4210135412"]}]},{"author_position":"middle","author":{"id":"https://openalex.org/A5002525813","display_name":"Elenilze F. B. Ferreira","orcid":"https://orcid.org/0000-0002-7085-7881","observed_orcids":["https://orcid.org/0000-0002-7085-7881"]},"institutions":[{"id":"https://openalex.org/I4210135412","display_name":"Universidade Federal do Amap\u00e1","ror":"https://ror.org/031va9m79","country_code":"BR","type":"education","lineage":["https://openalex.org/I4210135412"]}],"countries":["BR"],"is_corresponding":false,"raw_author_name":"Elenilze F. B. Ferreira","raw_affiliation_strings":["Laboratory of Modeling and Computational Chemistry, Department of Biological and Health Sciences, Federal University of Amap\u00e1, Macap\u00e1, AP, 68903-419, Brazil"],"raw_orcid":null,"affiliations":[{"raw_affiliation_string":"Laboratory of Modeling and Computational Chemistry, Department of Biological and Health Sciences, Federal University of Amap\u00e1, Macap\u00e1, AP, 68903-419, Brazil","institution_ids":["https://openalex.org/I4210135412"]}]},{"author_position":"middle","author":{"id":"https://openalex.org/A5084711108","display_name":"Jefferson Almeida Rocha","orcid":"https://orcid.org/0000-0001-6619-2293","observed_orcids":["https://orcid.org/0000-0001-6619-2293"]},"institutions":[{"id":"https://openalex.org/I47327664","display_name":"Universidade Federal do Maranh\u00e3o","ror":"https://ror.org/043fhe951","country_code":"BR","type":"education","lineage":["https://openalex.org/I47327664"]}],"countries":["BR"],"is_corresponding":false,"raw_author_name":"Jefferson A. Rocha","raw_affiliation_strings":["Research Group in Medicinal Chemistry and Biotechnology, QUIMEBIO, Federal University of Maranh\u00e3o, S\u00e3o Bernardo, MA, 65550-000, Brazil"],"raw_orcid":null,"affiliations":[{"raw_affiliation_string":"Research Group in Medicinal Chemistry and Biotechnology, QUIMEBIO, Federal University of Maranh\u00e3o, S\u00e3o Bernardo, MA, 65550-000, Brazil","institution_ids":["https://openalex.org/I47327664"]}]},{"author_position":"last","author":{"id":"https://openalex.org/A5007254919","display_name":"Cleydson B. R. Santos","orcid":"https://orcid.org/0000-0002-0271-335X","observed_orcids":["https://orcid.org/0000-0002-0271-335X"]},"institutions":[{"id":"https://openalex.org/I59606676","display_name":"Universidade Federal do Par\u00e1","ror":"https://ror.org/03q9sr818","country_code":"BR","type":"education","lineage":["https://openalex.org/I59606676"]}],"countries":["BR"],"is_corresponding":false,"raw_author_name":"Cleydson B. R. Santos","raw_affiliation_strings":["Graduate Program in Medicinal Chemistry and Molecular Modeling, Federal University of Par\u00e1, Bel\u00e9m, PA, 66075-110, Brazil"],"raw_orcid":null,"affiliations":[{"raw_affiliation_string":"Graduate Program in Medicinal Chemistry and Molecular Modeling, Federal University of Par\u00e1, Bel\u00e9m, PA, 66075-110, Brazil","institution_ids":["https://openalex.org/I59606676"]}]}],"institutions":[],"countries_distinct_count":1,"institutions_distinct_count":3,"corresponding_author_ids":[],"corresponding_institution_ids":[],"apc_list":null,"apc_paid":null,"fwci":0.0,"has_fulltext":false,"cited_by_count":2,"citation_normalized_percentile":{"value":0.0,"is_in_top_1_percent":false,"is_in_top_10_percent":false},"cited_by_percentile_year":{"min":89,"max":95},"biblio":{"volume":"18","issue":"6","first_page":"1702","last_page":"1713"},"is_retracted":false,"is_paratext":false,"is_xpac":false,"primary_topic":{"id":"https://openalex.org/T10163","display_name":"Metal complexes synthesis and properties","score":0.9628999829292297,"subfield":{"id":"https://openalex.org/subfields/2730","display_name":"Oncology"},"field":{"id":"https://openalex.org/fields/27","display_name":"Medicine"},"domain":{"id":"https://openalex.org/domains/4","display_name":"Health Sciences"}},"topics":[{"id":"https://openalex.org/T10163","display_name":"Metal complexes synthesis and properties","score":0.9628999829292297,"subfield":{"id":"https://openalex.org/subfields/2730","display_name":"Oncology"},"field":{"id":"https://openalex.org/fields/27","display_name":"Medicine"},"domain":{"id":"https://openalex.org/domains/4","display_name":"Health Sciences"}},{"id":"https://openalex.org/T10211","display_name":"Computational Drug Discovery Methods","score":0.008899999782443047,"subfield":{"id":"https://openalex.org/subfields/3002","display_name":"Drug Discovery"},"field":{"id":"https://openalex.org/fields/30","display_name":"Pharmacology, Toxicology and Pharmaceutics"},"domain":{"id":"https://openalex.org/domains/1","display_name":"Life Sciences"}},{"id":"https://openalex.org/T12458","display_name":"Organometallic Compounds Synthesis and Characterization","score":0.00839999970048666,"subfield":{"id":"https://openalex.org/subfields/1605","display_name":"Organic Chemistry"},"field":{"id":"https://openalex.org/fields/16","display_name":"Chemistry"},"domain":{"id":"https://openalex.org/domains/3","display_name":"Physical Sciences"}}],"keywords":[{"id":"https://openalex.org/keywords/cadmium-ii-complexes","display_name":"cadmium(II) complexes","score":0.9700000286102295},{"id":"https://openalex.org/keywords/4-7-dimethyl-1-10-phenanthroline","display_name":"4,7-dimethyl-1,10-phenanthroline","score":0.9409999847412109},{"id":"https://openalex.org/keywords/antibacterial-activity","display_name":"antibacterial activity","score":0.7049999833106995},{"id":"https://openalex.org/keywords/enterococcus-faecalis","display_name":"Enterococcus faecalis","score":0.871999979019165},{"id":"https://openalex.org/keywords/staphylococcus-aureus","display_name":"Staphylococcus aureus","score":1.0},{"id":"https://openalex.org/keywords/minimum-inhibitory-concentration","display_name":"minimum inhibitory concentration","score":0.9190000295639038},{"id":"https://openalex.org/keywords/molecular-docking","display_name":"molecular docking","score":0.9309999942779541},{"id":"https://openalex.org/keywords/admet-prediction","display_name":"ADMET prediction","score":0.8769999742507935},{"id":"https://openalex.org/keywords/pharmacokinetic-prediction","display_name":"pharmacokinetic prediction","score":0.7110000252723694},{"id":"https://openalex.org/keywords/toxicological-prediction","display_name":"toxicological prediction","score":0.7580000162124634},{"id":"https://openalex.org/keywords/metal-based-antibacterial-agents","display_name":"metal-based antibacterial agents","score":0.6570000052452087},{"id":"https://openalex.org/keywords/drug-resistance","display_name":"drug resistance","score":0.49300000071525574}],"concepts":[{"id":"https://openalex.org/C2779895986","wikidata":"https://www.wikidata.org/wiki/Q140014","display_name":"Enterococcus faecalis","level":4,"score":0.7841379642486572},{"id":"https://openalex.org/C544657597","wikidata":"https://www.wikidata.org/wiki/Q1091","display_name":"Cadmium","level":2,"score":0.6330939531326294},{"id":"https://openalex.org/C69366308","wikidata":"https://www.wikidata.org/wiki/Q2272286","display_name":"ADME","level":3,"score":0.6062430739402771},{"id":"https://openalex.org/C185592680","wikidata":"https://www.wikidata.org/wiki/Q2329","display_name":"Chemistry","level":0,"score":0.6061012148857117},{"id":"https://openalex.org/C2780104969","wikidata":"https://www.wikidata.org/wiki/Q4774530","display_name":"Antibacterial activity","level":3,"score":0.5903438329696655},{"id":"https://openalex.org/C2775905019","wikidata":"https://www.wikidata.org/wiki/Q192572","display_name":"In silico","level":3,"score":0.5233156681060791},{"id":"https://openalex.org/C2777660389","wikidata":"https://www.wikidata.org/wiki/Q416005","display_name":"Phenanthroline","level":2,"score":0.5100389122962952},{"id":"https://openalex.org/C202751555","wikidata":"https://www.wikidata.org/wiki/Q221681","display_name":"In vitro","level":2,"score":0.49818897247314453},{"id":"https://openalex.org/C176947019","wikidata":"https://www.wikidata.org/wiki/Q597889","display_name":"Minimum inhibitory concentration","level":3,"score":0.4980807304382324},{"id":"https://openalex.org/C544153396","wikidata":"https://www.wikidata.org/wiki/Q11426","display_name":"Metal","level":2,"score":0.4643784761428833},{"id":"https://openalex.org/C2779489039","wikidata":"https://www.wikidata.org/wiki/Q188121","display_name":"Staphylococcus aureus","level":3,"score":0.43756672739982605},{"id":"https://openalex.org/C13965031","wikidata":"https://www.wikidata.org/wiki/Q243545","display_name":"Nuclear chemistry","level":1,"score":0.38574182987213135},{"id":"https://openalex.org/C71240020","wikidata":"https://www.wikidata.org/wiki/Q186011","display_name":"Stereochemistry","level":1,"score":0.377336323261261},{"id":"https://openalex.org/C21951064","wikidata":"https://www.wikidata.org/wiki/Q899212","display_name":"Combinatorial chemistry","level":1,"score":0.3481432795524597},{"id":"https://openalex.org/C523546767","wikidata":"https://www.wikidata.org/wiki/Q10876","display_name":"Bacteria","level":2,"score":0.27433809638023376},{"id":"https://openalex.org/C55493867","wikidata":"https://www.wikidata.org/wiki/Q7094","display_name":"Biochemistry","level":1,"score":0.2119477391242981},{"id":"https://openalex.org/C547475151","wikidata":"https://www.wikidata.org/wiki/Q25419","display_name":"Escherichia coli","level":3,"score":0.19488954544067383},{"id":"https://openalex.org/C86803240","wikidata":"https://www.wikidata.org/wiki/Q420","display_name":"Biology","level":0,"score":0.1480816900730133},{"id":"https://openalex.org/C178790620","wikidata":"https://www.wikidata.org/wiki/Q11351","display_name":"Organic chemistry","level":1,"score":0.11976587772369385},{"id":"https://openalex.org/C54355233","wikidata":"https://www.wikidata.org/wiki/Q7162","display_name":"Genetics","level":1,"score":0.05357927083969116},{"id":"https://openalex.org/C104317684","wikidata":"https://www.wikidata.org/wiki/Q7187","display_name":"Gene","level":2,"score":0.0}],"mesh":[],"locations_count":1,"locations":[{"id":"doi:10.1166/jctn.2021.9726","doi":"https://doi.org/10.1166/jctn.2021.9726","is_oa":false,"landing_page_url":"https://doi.org/10.1166/jctn.2021.9726","pdf_url":null,"source":{"id":"https://openalex.org/S6195976","display_name":"Journal of Computational and Theoretical Nanoscience","issn_l":"1546-1955","issn":["1546-1955","1546-1963"],"is_oa":false,"is_in_doaj":false,"is_core":true,"listed_in":["anvur-scientific","cwts-core","poland-20","russia-white-list-3"],"host_organization":"https://openalex.org/P4310321646","host_organization_name":"American Scientific Publishers","host_organization_lineage":["https://openalex.org/P4310321646"],"host_organization_lineage_names":["American Scientific Publishers"],"type":"journal"},"license":null,"license_id":null,"version":"publishedVersion","is_accepted":true,"is_published":true,"raw_source_name":"Journal of Computational and Theoretical Nanoscience","raw_type":"journal-article"}],"best_oa_location":null,"sustainable_development_goals":[{"score":0.663100004196167,"id":"https://metadata.un.org/sdg/3","display_name":"Good health and well-being"}],"study_designs":[],"awards":[],"funders":[],"has_content":{"grobid_xml":false,"pdf":false},"content_urls":null,"referenced_works_count":32,"referenced_works":["https://openalex.org/W1526205344","https://openalex.org/W1526520698","https://openalex.org/W1972210398","https://openalex.org/W1999866520","https://openalex.org/W2000078605","https://openalex.org/W2029943266","https://openalex.org/W2038783118","https://openalex.org/W2091271911","https://openalex.org/W2092815169","https://openalex.org/W2108968616","https://openalex.org/W2110559046","https://openalex.org/W2118630726","https://openalex.org/W2130266402","https://openalex.org/W2132629607","https://openalex.org/W2167237095","https://openalex.org/W2327517660","https://openalex.org/W2399750301","https://openalex.org/W2470246927","https://openalex.org/W2498834817","https://openalex.org/W2512335602","https://openalex.org/W2626371132","https://openalex.org/W2735463849","https://openalex.org/W2774740825","https://openalex.org/W2810443508","https://openalex.org/W2885125942","https://openalex.org/W2942864955","https://openalex.org/W2957114060","https://openalex.org/W2970856497","https://openalex.org/W2975985829","https://openalex.org/W3085552768","https://openalex.org/W4240629553","https://openalex.org/W4252459023"],"related_works":["https://openalex.org/W4224215897","https://openalex.org/W4401934063","https://openalex.org/W6977460730","https://openalex.org/W4414382452","https://openalex.org/W7134197173","https://openalex.org/W4406254572","https://openalex.org/W2890782125","https://openalex.org/W2055159592","https://openalex.org/W3131297212","https://openalex.org/W2963918948"],"abstract_inverted_index":{"The":[0,73,173],"bacteria":[1],"are":[2],"responsible":[3],"for":[4,56,60,93,155],"several":[5,150],"diseases":[6],"in":[7,15,31],"humans":[8],"and":[9,30,52,58,64,68,85,96,105,128,135],"currently":[10],"there":[11],"is":[12],"an":[13],"increase":[14],"the":[16,36,106,115,119,123,146,152,177,180],"development":[17],"of":[18,35,82,90,111,151,179],"resistance":[19],"to":[20,122,168],"commercial":[21],"drugs.":[22],"In":[23,28,74],"this":[24],"study,":[25],"we":[26],"evaluated":[27],"Vitro":[29,75],"silico":[32],"antibacterial":[33,76,186],"potential":[34,156,185],"metal":[37],"complex":[38,107,148,182],"di-\u03bc-chloro-bis":[39],"[chlorine":[40],"(4,":[41],"7-dimethyl-1,":[42],"10-phenanthroline)":[43],"cadmium":[44,147,181],"(II)].":[45],"Computational":[46],"techniques,":[47],"DFT":[48],"with":[49,70,117],"hybrid":[50],"functional":[51],"B3LYP/GEN":[53],"base":[54],"(LANL2DZ":[55],"Cd":[57],"6\u2013311++G**":[59],"C,":[61],"N,":[62],"Cl":[63],"H),":[65],"were":[66,103,138],"applied":[67],"compared":[69],"literature":[71],"data.":[72],"biological":[77],"assays":[78],"revealed":[79],"a":[80,86,164,184],"halo":[81],"16":[83],"mm":[84],"minimum":[87],"inhibitory":[88],"concentration":[89],"6.25":[91],"\u03bcg/cm3;":[92],"Enterococcus":[94],"faecalis":[95,125],"Staphylococcus.":[97],"aureus,":[98],"respectively.":[99],"Molecular":[100],"docking":[101],"simulations":[102],"realized":[104],"presented":[108],"satisfactory":[109],"results":[110,142,174],"binding":[112],"energy":[113],"showing":[114],"ease":[116],"which":[118],"ligand":[120],"binds":[121],"E.":[124],"(\u22128.14":[126],"kcal/mol)":[127],"S.":[129],"aureus":[130],"(\u22127.00":[131],"kcal/mol).":[132],"Additionally,":[133],"pharmacokinetic":[134],"toxicological":[136],"predictions":[137],"realized.":[139],"ADME/Tox":[140],"profile":[141],"showed":[143],"that,":[144],"although":[145],"met":[149],"parameters":[153],"required":[154],"drugs,":[157],"it":[158],"has":[159],"not":[160],"been":[161],"classified":[162],"as":[163,183],"suitable":[165],"one":[166],"due":[167],"its":[169],"high":[170],"molecular":[171],"weight.":[172],"obtained":[175],"demonstrate":[176],"effectiveness":[178],"agent.":[187]},"counts_by_year":[{"year":2026,"cited_by_count":1},{"year":2025,"cited_by_count":1}],"updated_date":"2026-11-04T10:54:05.112534","created_date":"2022-07-15T00:00:00"}