{"id":"https://openalex.org/W7225244456","doi":"https://doi.org/10.1002/cmdc.70503","title":"What Method and Library Size Is Best for Fragment Screening?","display_name":"What Method and Library Size Is Best for Fragment Screening?","publication_year":2026,"publication_date":"2026-11-03","ids":{"openalex":"https://openalex.org/W7225244456","doi":"https://doi.org/10.1002/cmdc.70503","pmid":"https://pubmed.ncbi.nlm.nih.gov/42978231","pmcid":"https://www.ncbi.nlm.nih.gov/pmc/articles/13731922"},"language":"en","primary_location":{"id":"doi:10.1002/cmdc.70503","doi":"https://doi.org/10.1002/cmdc.70503","is_oa":true,"landing_page_url":"https://doi.org/10.1002/cmdc.70503","pdf_url":"https://onlinelibrary.wiley.com/doi/pdfdirect/10.1002/cmdc.70503","source":{"id":"https://openalex.org/S136164820","display_name":"ChemMedChem","issn_l":"1860-7179","issn":["1860-7179","1860-7187"],"is_oa":false,"is_in_doaj":false,"is_core":true,"listed_in":["cwts-core","dongbi-c","jufo-1","ki-jl-1","medline","norway-1","poland-100","russia-white-list-2","vabb-shw"],"host_organization":"https://openalex.org/P4310320595","host_organization_name":"Wiley","host_organization_lineage":["https://openalex.org/P4310320595"],"host_organization_lineage_names":["Wiley"],"type":"journal"},"license":"cc-by","license_id":"https://openalex.org/licenses/cc-by","version":"publishedVersion","is_accepted":true,"is_published":true,"raw_source_name":"ChemMedChem","raw_type":"journal-article"},"volume":null,"type":"article","is_traditional":true,"indexed_in":["crossref","pubmed"],"open_access":{"is_oa":true,"oa_status":"hybrid","oa_url":"https://onlinelibrary.wiley.com/doi/pdfdirect/10.1002/cmdc.70503","any_repository_has_fulltext":true},"authorships":[{"author_position":"first","author":{"id":"https://openalex.org/A5007570322","display_name":"Stephen W. Fesik","orcid":"https://orcid.org/0000-0001-5957-6192","observed_orcids":["https://orcid.org/0000-0001-5957-6192"]},"institutions":[{"id":"https://openalex.org/I200719446","display_name":"Vanderbilt University","ror":"https://ror.org/02vm5rt34","country_code":"US","type":"education","lineage":["https://openalex.org/I200719446"]}],"countries":["US"],"is_corresponding":true,"raw_author_name":"Stephen W. Fesik","raw_affiliation_strings":["Departments of Biochemistry, Pharmacology and Chemistry Vanderbilt University  Nashville Tennessee USA"],"raw_orcid":"https://orcid.org/0000-0001-5957-6192","affiliations":[{"raw_affiliation_string":"Departments of Biochemistry, Pharmacology and Chemistry Vanderbilt University  Nashville Tennessee USA","institution_ids":["https://openalex.org/I200719446"]}]}],"institutions":[],"countries_distinct_count":1,"institutions_distinct_count":1,"corresponding_author_ids":["https://openalex.org/A5007570322"],"corresponding_institution_ids":["https://openalex.org/I200719446"],"apc_list":{"value":4150,"currency":"USD","value_usd":4150},"apc_paid":{"value":4150,"currency":"USD","value_usd":4150},"fwci":0.0,"has_fulltext":true,"cited_by_count":0,"citation_normalized_percentile":{"value":0.79192049,"is_in_top_1_percent":false,"is_in_top_10_percent":false},"cited_by_percentile_year":null,"biblio":{"volume":"21","issue":"21","first_page":null,"last_page":null},"is_retracted":false,"is_paratext":false,"is_xpac":false,"primary_topic":{"id":"https://openalex.org/T10211","display_name":"Computational Drug Discovery Methods","score":0.9355000257492065,"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"}},"topics":[{"id":"https://openalex.org/T10211","display_name":"Computational Drug Discovery Methods","score":0.9355000257492065,"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/T10911","display_name":"Chemical Synthesis and Analysis","score":0.04569999873638153,"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"}},{"id":"https://openalex.org/T12534","display_name":"Protein Degradation and Inhibitors","score":0.0007999999797903001,"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/fragment-based-screening","display_name":"fragment screening","score":0.8090000152587891},{"id":"https://openalex.org/keywords/fragment-based-drug-discovery","display_name":"fragment-based drug discovery","score":0.9350000023841858},{"id":"https://openalex.org/keywords/fragment-libraries","display_name":"fragment libraries","score":0.8420000076293945},{"id":"https://openalex.org/keywords/library-size","display_name":"library size","score":0.8949999809265137},{"id":"https://openalex.org/keywords/screening-method","display_name":"screening method","score":0.6800000071525574},{"id":"https://openalex.org/keywords/hit-identification","display_name":"hit identification","score":0.6100000143051147}],"concepts":[{"id":"https://openalex.org/C2776235265","wikidata":"https://www.wikidata.org/wiki/Q18392052","display_name":"Fragment (logic)","level":2,"score":0.9830999970436096},{"id":"https://openalex.org/C41008148","wikidata":"https://www.wikidata.org/wiki/Q21198","display_name":"Computer science","level":0,"score":0.5354999899864197},{"id":"https://openalex.org/C74187038","wikidata":"https://www.wikidata.org/wiki/Q1418791","display_name":"Drug discovery","level":2,"score":0.34439998865127563},{"id":"https://openalex.org/C70721500","wikidata":"https://www.wikidata.org/wiki/Q177005","display_name":"Computational biology","level":1,"score":0.3212999999523163},{"id":"https://openalex.org/C185592680","wikidata":"https://www.wikidata.org/wiki/Q2329","display_name":"Chemistry","level":0,"score":0.3082999885082245},{"id":"https://openalex.org/C21951064","wikidata":"https://www.wikidata.org/wiki/Q899212","display_name":"Combinatorial chemistry","level":1,"score":0.3077999949455261},{"id":"https://openalex.org/C23123220","wikidata":"https://www.wikidata.org/wiki/Q816826","display_name":"Information retrieval","level":1,"score":0.2727000117301941},{"id":"https://openalex.org/C11413529","wikidata":"https://www.wikidata.org/wiki/Q8366","display_name":"Algorithm","level":1,"score":0.2718000113964081},{"id":"https://openalex.org/C154945302","wikidata":"https://www.wikidata.org/wiki/Q11660","display_name":"Artificial intelligence","level":1,"score":0.27129998803138733},{"id":"https://openalex.org/C71240020","wikidata":"https://www.wikidata.org/wiki/Q186011","display_name":"Stereochemistry","level":1,"score":0.2603999972343445}],"mesh":[{"descriptor_ui":"D006801","descriptor_name":"Humans","qualifier_ui":null,"qualifier_name":null,"is_major_topic":false},{"descriptor_ui":"D054852","descriptor_name":"Small Molecule Libraries","qualifier_ui":"Q000737","qualifier_name":"chemistry","is_major_topic":true},{"descriptor_ui":"D055808","descriptor_name":"Drug Discovery","qualifier_ui":"Q000379","qualifier_name":"methods","is_major_topic":true}],"locations_count":3,"locations":[{"id":"doi:10.1002/cmdc.70503","doi":"https://doi.org/10.1002/cmdc.70503","is_oa":true,"landing_page_url":"https://doi.org/10.1002/cmdc.70503","pdf_url":"https://onlinelibrary.wiley.com/doi/pdfdirect/10.1002/cmdc.70503","source":{"id":"https://openalex.org/S136164820","display_name":"ChemMedChem","issn_l":"1860-7179","issn":["1860-7179","1860-7187"],"is_oa":false,"is_in_doaj":false,"is_core":true,"listed_in":["cwts-core","dongbi-c","jufo-1","ki-jl-1","medline","norway-1","poland-100","russia-white-list-2","vabb-shw"],"host_organization":"https://openalex.org/P4310320595","host_organization_name":"Wiley","host_organization_lineage":["https://openalex.org/P4310320595"],"host_organization_lineage_names":["Wiley"],"type":"journal"},"license":"cc-by","license_id":"https://openalex.org/licenses/cc-by","version":"publishedVersion","is_accepted":true,"is_published":true,"raw_source_name":"ChemMedChem","raw_type":"journal-article"},{"id":"pmh:oai:pubmedcentral.nih.gov:13731922","doi":null,"is_oa":true,"landing_page_url":"https://pmc.ncbi.nlm.nih.gov/articles/PMC13731922/","pdf_url":"https://pmc.ncbi.nlm.nih.gov/articles/PMC13731922/pdf/CMDC-21-e70503.pdf","source":{"id":"https://openalex.org/S2764455111","display_name":"PubMed Central","issn_l":null,"issn":null,"is_oa":true,"is_in_doaj":false,"is_core":false,"listed_in":[],"host_organization":"https://openalex.org/I1299303238","host_organization_name":"National Institutes of Health","host_organization_lineage":["https://openalex.org/I1299303238"],"host_organization_lineage_names":[],"type":"repository"},"license":"cc-by","license_id":"https://openalex.org/licenses/cc-by","version":"publishedVersion","is_accepted":true,"is_published":true,"raw_source_name":"ChemMedChem","raw_type":"Text"},{"id":"pmid:42978231","doi":null,"is_oa":false,"landing_page_url":"https://pubmed.ncbi.nlm.nih.gov/42978231","pdf_url":null,"source":{"id":"https://openalex.org/S4306525036","display_name":"PubMed","issn_l":null,"issn":null,"is_oa":false,"is_in_doaj":false,"is_core":false,"listed_in":[],"host_organization":"https://openalex.org/I1299303238","host_organization_name":"National Institutes of Health","host_organization_lineage":["https://openalex.org/I1299303238"],"host_organization_lineage_names":[],"type":"repository"},"license":null,"license_id":null,"version":"publishedVersion","is_accepted":true,"is_published":true,"raw_source_name":"ChemMedChem","raw_type":"Journal Article"}],"best_oa_location":{"id":"doi:10.1002/cmdc.70503","doi":"https://doi.org/10.1002/cmdc.70503","is_oa":true,"landing_page_url":"https://doi.org/10.1002/cmdc.70503","pdf_url":"https://onlinelibrary.wiley.com/doi/pdfdirect/10.1002/cmdc.70503","source":{"id":"https://openalex.org/S136164820","display_name":"ChemMedChem","issn_l":"1860-7179","issn":["1860-7179","1860-7187"],"is_oa":false,"is_in_doaj":false,"is_core":true,"listed_in":["cwts-core","dongbi-c","jufo-1","ki-jl-1","medline","norway-1","poland-100","russia-white-list-2","vabb-shw"],"host_organization":"https://openalex.org/P4310320595","host_organization_name":"Wiley","host_organization_lineage":["https://openalex.org/P4310320595"],"host_organization_lineage_names":["Wiley"],"type":"journal"},"license":"cc-by","license_id":"https://openalex.org/licenses/cc-by","version":"publishedVersion","is_accepted":true,"is_published":true,"raw_source_name":"ChemMedChem","raw_type":"journal-article"},"sustainable_development_goals":[],"study_designs":[],"awards":[],"funders":[],"has_content":{"pdf":true,"grobid_xml":true},"content_urls":{"pdf":"https://content.openalex.org/works/W7225244456.pdf","grobid_xml":"https://content.openalex.org/works/W7225244456.grobid-xml"},"referenced_works_count":21,"referenced_works":["https://openalex.org/W1972091733","https://openalex.org/W1982393730","https://openalex.org/W2091562724","https://openalex.org/W2091864876","https://openalex.org/W2147281292","https://openalex.org/W2467779447","https://openalex.org/W2784064188","https://openalex.org/W2926677816","https://openalex.org/W2996418500","https://openalex.org/W4307425458","https://openalex.org/W4378172206","https://openalex.org/W4398221296","https://openalex.org/W4401324571","https://openalex.org/W4405079010","https://openalex.org/W4410084456","https://openalex.org/W4411984082","https://openalex.org/W4412653611","https://openalex.org/W4413758899","https://openalex.org/W4416162056","https://openalex.org/W4416669724","https://openalex.org/W7161777045"],"related_works":["https://openalex.org/W1545712001","https://openalex.org/W4402023030","https://openalex.org/W2963031998","https://openalex.org/W2147822819","https://openalex.org/W2014091120","https://openalex.org/W2984855178","https://openalex.org/W2467779447","https://openalex.org/W2092557302","https://openalex.org/W2075155287","https://openalex.org/W4406560471"],"abstract_inverted_index":{"Fragment":[0],"screening":[1,44],"is":[2],"widely":[3,29],"used":[4,19],"to":[5],"provide":[6,58],"useful":[7],"starting":[8],"points":[9],"for":[10,21,42,54],"drug":[11],"discovery.":[12],"There":[13],"are":[14,18],"many":[15],"methods":[16],"that":[17,39,61],"today":[20],"conducting":[22],"fragment-based":[23],"screens.":[24],"and":[25,45,57],"fragment":[26,43,50],"libraries":[27],"vary":[28],"in":[30],"size.":[31],"In":[32],"this":[33],"perspective,":[34],"I":[35,40],"discuss":[36],"the":[37,46,52,63],"method":[38],"use":[41],"size":[47],"of":[48],"my":[49],"library,":[51],"reasons":[53],"these":[55],"choices,":[56],"an":[59],"example":[60],"illustrates":[62],"advantages.":[64]},"counts_by_year":[],"updated_date":"2026-11-09T13:22:03.289127","created_date":"2026-11-05T00:00:00"}
