{"id":"https://openalex.org/W4312634649","doi":"https://doi.org/10.1504/ijcbdd.2022.10051973","title":"Modelling and molecular dynamics simulation of novel anticancer ligand for restructuring mutant P53 into wild type","display_name":"Modelling and molecular dynamics simulation of novel anticancer ligand for restructuring mutant P53 into wild type","publication_year":2022,"publication_date":"2022-01-01","ids":{"openalex":"https://openalex.org/W4312634649","doi":"https://doi.org/10.1504/ijcbdd.2022.10051973"},"language":"en","primary_location":{"id":"doi:10.1504/ijcbdd.2022.10051973","is_oa":false,"landing_page_url":"https://doi.org/10.1504/ijcbdd.2022.10051973","pdf_url":null,"source":{"id":"https://openalex.org/S200215862","display_name":"International Journal of Computational Biology and Drug Design","issn_l":"1756-0756","issn":["1756-0756","1756-0764"],"is_oa":false,"is_in_doaj":false,"is_core":true,"host_organization":"https://openalex.org/P4310317825","host_organization_name":"Inderscience Publishers","host_organization_lineage":["https://openalex.org/P4310317825"],"host_organization_lineage_names":["Inderscience Publishers"],"type":"journal"},"license":null,"license_id":null,"version":"publishedVersion","is_accepted":true,"is_published":true,"raw_source_name":"International Journal of Computational Biology and Drug Design","raw_type":"journal-article"},"type":"article","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/A5041423116","display_name":"Souvik Basak","orcid":"https://orcid.org/0000-0003-0380-6264"},"institutions":[],"countries":[],"is_corresponding":true,"raw_author_name":"Souvik Basak","raw_affiliation_strings":[],"affiliations":[]},{"author_position":"middle","author":{"id":"https://openalex.org/A5031384822","display_name":"Amit Kumar Halder","orcid":"https://orcid.org/0000-0002-4818-9047"},"institutions":[],"countries":[],"is_corresponding":false,"raw_author_name":"Amit Kumar Halder","raw_affiliation_strings":[],"affiliations":[]},{"author_position":"middle","author":{"id":"https://openalex.org/A5073433426","display_name":"Puja Mishra","orcid":"https://orcid.org/0000-0002-8531-0942"},"institutions":[],"countries":[],"is_corresponding":false,"raw_author_name":"Puja Mishra","raw_affiliation_strings":[],"affiliations":[]},{"author_position":"middle","author":{"id":"https://openalex.org/A5077571004","display_name":"Achintya Saha","orcid":"https://orcid.org/0000-0002-0205-7719"},"institutions":[],"countries":[],"is_corresponding":false,"raw_author_name":"Achintya Saha","raw_affiliation_strings":[],"affiliations":[]},{"author_position":"middle","author":{"id":"https://openalex.org/A5019890183","display_name":"Moloy Roy","orcid":null},"institutions":[],"countries":[],"is_corresponding":false,"raw_author_name":"Moloy Roy","raw_affiliation_strings":[],"affiliations":[]},{"author_position":"middle","author":{"id":"https://openalex.org/A5060837852","display_name":"Aditi Gangopadhyay","orcid":"https://orcid.org/0000-0002-1951-8462"},"institutions":[],"countries":[],"is_corresponding":false,"raw_author_name":"Aditi Gangopadhyay","raw_affiliation_strings":[],"affiliations":[]},{"author_position":"last","author":{"id":"https://openalex.org/A5074148701","display_name":"Ashik Chhetri","orcid":"https://orcid.org/0009-0009-2540-7927"},"institutions":[],"countries":[],"is_corresponding":false,"raw_author_name":"Ashik Chhetri","raw_affiliation_strings":[],"affiliations":[]}],"institutions":[],"countries_distinct_count":0,"institutions_distinct_count":7,"corresponding_author_ids":["https://openalex.org/A5041423116"],"corresponding_institution_ids":[],"apc_list":null,"apc_paid":null,"fwci":0.0,"has_fulltext":false,"cited_by_count":0,"citation_normalized_percentile":{"value":0.26666667,"is_in_top_1_percent":false,"is_in_top_10_percent":false},"cited_by_percentile_year":null,"biblio":{"volume":"15","issue":"2","first_page":"77","last_page":"77"},"is_retracted":false,"is_paratext":false,"is_xpac":false,"primary_topic":{"id":"https://openalex.org/T10583","display_name":"Cancer-related Molecular Pathways","score":0.8999000191688538,"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/T10583","display_name":"Cancer-related Molecular Pathways","score":0.8999000191688538,"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/T12996","display_name":"Cancer Research and Treatments","score":0.8008999824523926,"subfield":{"id":"https://openalex.org/subfields/1305","display_name":"Biotechnology"},"field":{"id":"https://openalex.org/fields/13","display_name":"Biochemistry, Genetics and Molecular Biology"},"domain":{"id":"https://openalex.org/domains/1","display_name":"Life Sciences"}},{"id":"https://openalex.org/T13937","display_name":"Genetics, Bioinformatics, and Biomedical Research","score":0.7849000096321106,"subfield":{"id":"https://openalex.org/subfields/1312","display_name":"Molecular Biology"},"field":{"id":"https://openalex.org/fields/13","display_name":"Biochemistry, Genetics and Molecular Biology"},"domain":{"id":"https://openalex.org/domains/1","display_name":"Life Sciences"}}],"keywords":[{"id":"https://openalex.org/keywords/mutant","display_name":"Mutant","score":0.6968841552734375},{"id":"https://openalex.org/keywords/restructuring","display_name":"Restructuring","score":0.6706427931785583},{"id":"https://openalex.org/keywords/molecular-dynamics","display_name":"Molecular dynamics","score":0.5948562622070312},{"id":"https://openalex.org/keywords/dynamics","display_name":"Dynamics (music)","score":0.5722454786300659},{"id":"https://openalex.org/keywords/wild-type","display_name":"Wild type","score":0.5011942386627197},{"id":"https://openalex.org/keywords/ligand","display_name":"Ligand (biochemistry)","score":0.49454233050346375},{"id":"https://openalex.org/keywords/computational-biology","display_name":"Computational biology","score":0.4460488259792328},{"id":"https://openalex.org/keywords/process","display_name":"Process (computing)","score":0.4316466450691223},{"id":"https://openalex.org/keywords/chemistry","display_name":"Chemistry","score":0.42445486783981323},{"id":"https://openalex.org/keywords/computer-science","display_name":"Computer science","score":0.361281156539917},{"id":"https://openalex.org/keywords/biological-system","display_name":"Biological system","score":0.3270219564437866},{"id":"https://openalex.org/keywords/biology","display_name":"Biology","score":0.29476600885391235},{"id":"https://openalex.org/keywords/business","display_name":"Business","score":0.25317198038101196},{"id":"https://openalex.org/keywords/physics","display_name":"Physics","score":0.15089359879493713},{"id":"https://openalex.org/keywords/biochemistry","display_name":"Biochemistry","score":0.14119479060173035},{"id":"https://openalex.org/keywords/computational-chemistry","display_name":"Computational chemistry","score":0.130135178565979},{"id":"https://openalex.org/keywords/gene","display_name":"Gene","score":0.12115916609764099},{"id":"https://openalex.org/keywords/receptor","display_name":"Receptor","score":0.11740747094154358}],"concepts":[{"id":"https://openalex.org/C143065580","wikidata":"https://www.wikidata.org/wiki/Q3285695","display_name":"Mutant","level":3,"score":0.6968841552734375},{"id":"https://openalex.org/C45237549","wikidata":"https://www.wikidata.org/wiki/Q1376796","display_name":"Restructuring","level":2,"score":0.6706427931785583},{"id":"https://openalex.org/C59593255","wikidata":"https://www.wikidata.org/wiki/Q901663","display_name":"Molecular dynamics","level":2,"score":0.5948562622070312},{"id":"https://openalex.org/C145912823","wikidata":"https://www.wikidata.org/wiki/Q113558","display_name":"Dynamics (music)","level":2,"score":0.5722454786300659},{"id":"https://openalex.org/C207583985","wikidata":"https://www.wikidata.org/wiki/Q128723","display_name":"Wild type","level":4,"score":0.5011942386627197},{"id":"https://openalex.org/C116569031","wikidata":"https://www.wikidata.org/wiki/Q899107","display_name":"Ligand (biochemistry)","level":3,"score":0.49454233050346375},{"id":"https://openalex.org/C70721500","wikidata":"https://www.wikidata.org/wiki/Q177005","display_name":"Computational biology","level":1,"score":0.4460488259792328},{"id":"https://openalex.org/C98045186","wikidata":"https://www.wikidata.org/wiki/Q205663","display_name":"Process (computing)","level":2,"score":0.4316466450691223},{"id":"https://openalex.org/C185592680","wikidata":"https://www.wikidata.org/wiki/Q2329","display_name":"Chemistry","level":0,"score":0.42445486783981323},{"id":"https://openalex.org/C41008148","wikidata":"https://www.wikidata.org/wiki/Q21198","display_name":"Computer science","level":0,"score":0.361281156539917},{"id":"https://openalex.org/C186060115","wikidata":"https://www.wikidata.org/wiki/Q30336093","display_name":"Biological system","level":1,"score":0.3270219564437866},{"id":"https://openalex.org/C86803240","wikidata":"https://www.wikidata.org/wiki/Q420","display_name":"Biology","level":0,"score":0.29476600885391235},{"id":"https://openalex.org/C144133560","wikidata":"https://www.wikidata.org/wiki/Q4830453","display_name":"Business","level":0,"score":0.25317198038101196},{"id":"https://openalex.org/C121332964","wikidata":"https://www.wikidata.org/wiki/Q413","display_name":"Physics","level":0,"score":0.15089359879493713},{"id":"https://openalex.org/C55493867","wikidata":"https://www.wikidata.org/wiki/Q7094","display_name":"Biochemistry","level":1,"score":0.14119479060173035},{"id":"https://openalex.org/C147597530","wikidata":"https://www.wikidata.org/wiki/Q369472","display_name":"Computational chemistry","level":1,"score":0.130135178565979},{"id":"https://openalex.org/C104317684","wikidata":"https://www.wikidata.org/wiki/Q7187","display_name":"Gene","level":2,"score":0.12115916609764099},{"id":"https://openalex.org/C170493617","wikidata":"https://www.wikidata.org/wiki/Q208467","display_name":"Receptor","level":2,"score":0.11740747094154358},{"id":"https://openalex.org/C10138342","wikidata":"https://www.wikidata.org/wiki/Q43015","display_name":"Finance","level":1,"score":0.0},{"id":"https://openalex.org/C111919701","wikidata":"https://www.wikidata.org/wiki/Q9135","display_name":"Operating system","level":1,"score":0.0},{"id":"https://openalex.org/C24890656","wikidata":"https://www.wikidata.org/wiki/Q82811","display_name":"Acoustics","level":1,"score":0.0}],"mesh":[],"locations_count":1,"locations":[{"id":"doi:10.1504/ijcbdd.2022.10051973","is_oa":false,"landing_page_url":"https://doi.org/10.1504/ijcbdd.2022.10051973","pdf_url":null,"source":{"id":"https://openalex.org/S200215862","display_name":"International Journal of Computational Biology and Drug Design","issn_l":"1756-0756","issn":["1756-0756","1756-0764"],"is_oa":false,"is_in_doaj":false,"is_core":true,"host_organization":"https://openalex.org/P4310317825","host_organization_name":"Inderscience Publishers","host_organization_lineage":["https://openalex.org/P4310317825"],"host_organization_lineage_names":["Inderscience Publishers"],"type":"journal"},"license":null,"license_id":null,"version":"publishedVersion","is_accepted":true,"is_published":true,"raw_source_name":"International Journal of Computational Biology and Drug Design","raw_type":"journal-article"}],"best_oa_location":null,"sustainable_development_goals":[{"score":0.7300000190734863,"display_name":"Zero hunger","id":"https://metadata.un.org/sdg/2"}],"awards":[],"funders":[],"has_content":{"grobid_xml":false,"pdf":false},"content_urls":null,"referenced_works_count":0,"referenced_works":[],"related_works":["https://openalex.org/W2899084033","https://openalex.org/W2748952813","https://openalex.org/W1980377213","https://openalex.org/W2355480038","https://openalex.org/W2031486883","https://openalex.org/W2012037973","https://openalex.org/W2049802625","https://openalex.org/W2086422257","https://openalex.org/W2372986731","https://openalex.org/W2018858360"],"abstract_inverted_index":null,"counts_by_year":[],"updated_date":"2025-11-06T03:46:38.306776","created_date":"2025-10-10T00:00:00"}
