{"id":"https://openalex.org/W2080537348","doi":"https://doi.org/10.1186/1471-2105-10-257","title":"Structure-based substrate screening for an enzyme","display_name":"Structure-based substrate screening for an enzyme","publication_year":2009,"publication_date":"2009-08-21","ids":{"openalex":"https://openalex.org/W2080537348","doi":"https://doi.org/10.1186/1471-2105-10-257","mag":"2080537348","pmid":"https://pubmed.ncbi.nlm.nih.gov/19695105"},"language":"en","primary_location":{"id":"doi:10.1186/1471-2105-10-257","is_oa":true,"landing_page_url":"https://doi.org/10.1186/1471-2105-10-257","pdf_url":"https://bmcbioinformatics.biomedcentral.com/counter/pdf/10.1186/1471-2105-10-257","source":{"id":"https://openalex.org/S19032547","display_name":"BMC Bioinformatics","issn_l":"1471-2105","issn":["1471-2105"],"is_oa":true,"is_in_doaj":true,"is_core":true,"host_organization":"https://openalex.org/P4310320256","host_organization_name":"BioMed Central","host_organization_lineage":["https://openalex.org/P4310320256","https://openalex.org/P4310319965"],"host_organization_lineage_names":["BioMed Central","Springer Nature"],"type":"journal"},"license":"cc-by","license_id":"https://openalex.org/licenses/cc-by","version":"publishedVersion","is_accepted":true,"is_published":true,"raw_source_name":"BMC Bioinformatics","raw_type":"journal-article"},"type":"article","indexed_in":["crossref","doaj","pubmed"],"open_access":{"is_oa":true,"oa_status":"gold","oa_url":"https://bmcbioinformatics.biomedcentral.com/counter/pdf/10.1186/1471-2105-10-257","any_repository_has_fulltext":true},"authorships":[{"author_position":"first","author":{"id":"https://openalex.org/A5100385891","display_name":"Tao Xu","orcid":"https://orcid.org/0000-0001-5436-0077"},"institutions":[{"id":"https://openalex.org/I143593769","display_name":"East China University of Science and Technology","ror":"https://ror.org/01vyrm377","country_code":"CN","type":"education","lineage":["https://openalex.org/I143593769"]}],"countries":["CN"],"is_corresponding":true,"raw_author_name":"Tao Xu","raw_affiliation_strings":["State Key Laboratory of Bioreactor Engineering, East China University of Science and Technology, Shanghai, PR China. robertxutao@mail.ecust.edu.cn","State Key Laboratory of Bioreactor Engineering, East China University of Science and Technology,, Shanghai, China"],"affiliations":[{"raw_affiliation_string":"State Key Laboratory of Bioreactor Engineering, East China University of Science and Technology, Shanghai, PR China. robertxutao@mail.ecust.edu.cn","institution_ids":["https://openalex.org/I143593769"]},{"raw_affiliation_string":"State Key Laboratory of Bioreactor Engineering, East China University of Science and Technology,, Shanghai, China","institution_ids":["https://openalex.org/I143593769"]}]},{"author_position":"middle","author":{"id":"https://openalex.org/A5055125525","display_name":"Lujia Zhang","orcid":"https://orcid.org/0000-0003-3566-917X"},"institutions":[{"id":"https://openalex.org/I143593769","display_name":"East China University of Science and Technology","ror":"https://ror.org/01vyrm377","country_code":"CN","type":"education","lineage":["https://openalex.org/I143593769"]}],"countries":["CN"],"is_corresponding":false,"raw_author_name":"Lujia Zhang","raw_affiliation_strings":["State Key Laboratory of Bioreactor Engineering, East China University of Science and Technology, Meilong Road, Shanghai, PR, China","State Key Laboratory of Bioreactor Engineering, East China University of Science and Technology,, Shanghai, China"],"affiliations":[{"raw_affiliation_string":"State Key Laboratory of Bioreactor Engineering, East China University of Science and Technology, Meilong Road, Shanghai, PR, China","institution_ids":["https://openalex.org/I143593769"]},{"raw_affiliation_string":"State Key Laboratory of Bioreactor Engineering, East China University of Science and Technology,, Shanghai, China","institution_ids":["https://openalex.org/I143593769"]}]},{"author_position":"middle","author":{"id":"https://openalex.org/A5100446397","display_name":"Xuedong Wang","orcid":"https://orcid.org/0000-0001-7618-5847"},"institutions":[{"id":"https://openalex.org/I143593769","display_name":"East China University of Science and Technology","ror":"https://ror.org/01vyrm377","country_code":"CN","type":"education","lineage":["https://openalex.org/I143593769"]}],"countries":["CN"],"is_corresponding":false,"raw_author_name":"Xuedong Wang","raw_affiliation_strings":["State Key Laboratory of Bioreactor Engineering, East China University of Science and Technology, Meilong Road, Shanghai, PR, China","State Key Laboratory of Bioreactor Engineering, East China University of Science and Technology,, Shanghai, China"],"affiliations":[{"raw_affiliation_string":"State Key Laboratory of Bioreactor Engineering, East China University of Science and Technology, Meilong Road, Shanghai, PR, China","institution_ids":["https://openalex.org/I143593769"]},{"raw_affiliation_string":"State Key Laboratory of Bioreactor Engineering, East China University of Science and Technology,, Shanghai, China","institution_ids":["https://openalex.org/I143593769"]}]},{"author_position":"middle","author":{"id":"https://openalex.org/A5046398218","display_name":"Dongzhi Wei","orcid":"https://orcid.org/0000-0003-3655-3937"},"institutions":[{"id":"https://openalex.org/I143593769","display_name":"East China University of Science and Technology","ror":"https://ror.org/01vyrm377","country_code":"CN","type":"education","lineage":["https://openalex.org/I143593769"]}],"countries":["CN"],"is_corresponding":false,"raw_author_name":"Dongzhi Wei","raw_affiliation_strings":["State Key Laboratory of Bioreactor Engineering, East China University of Science and Technology, Meilong Road, Shanghai, PR, China","State Key Laboratory of Bioreactor Engineering, East China University of Science and Technology,, Shanghai, China"],"affiliations":[{"raw_affiliation_string":"State Key Laboratory of Bioreactor Engineering, East China University of Science and Technology, Meilong Road, Shanghai, PR, China","institution_ids":["https://openalex.org/I143593769"]},{"raw_affiliation_string":"State Key Laboratory of Bioreactor Engineering, East China University of Science and Technology,, Shanghai, China","institution_ids":["https://openalex.org/I143593769"]}]},{"author_position":"last","author":{"id":"https://openalex.org/A5086398382","display_name":"Tianbi Li","orcid":"https://orcid.org/0000-0002-9343-1461"},"institutions":[{"id":"https://openalex.org/I2799553609","display_name":"Rothamsted Research","ror":"https://ror.org/0347fy350","country_code":"GB","type":"facility","lineage":["https://openalex.org/I2799553609","https://openalex.org/I2799693246","https://openalex.org/I4210087105"]}],"countries":["GB"],"is_corresponding":false,"raw_author_name":"Tianbi Li","raw_affiliation_strings":["Biological Chemistry Department, Rothamsted Research, Harpenden, AL5 2JQ, UK","Biological Chemistry Department, Rothamsted Research, Harpenden, UK"],"affiliations":[{"raw_affiliation_string":"Biological Chemistry Department, Rothamsted Research, Harpenden, AL5 2JQ, UK","institution_ids":["https://openalex.org/I2799553609"]},{"raw_affiliation_string":"Biological Chemistry Department, Rothamsted Research, Harpenden, UK","institution_ids":["https://openalex.org/I2799553609"]}]}],"institutions":[],"countries_distinct_count":2,"institutions_distinct_count":5,"corresponding_author_ids":["https://openalex.org/A5100385891"],"corresponding_institution_ids":["https://openalex.org/I143593769"],"apc_list":{"value":1690,"currency":"GBP","value_usd":2072},"apc_paid":{"value":1690,"currency":"GBP","value_usd":2072},"fwci":0.1348,"has_fulltext":true,"cited_by_count":12,"citation_normalized_percentile":{"value":0.54881138,"is_in_top_1_percent":false,"is_in_top_10_percent":false},"cited_by_percentile_year":{"min":89,"max":98},"biblio":{"volume":"10","issue":"1","first_page":"257","last_page":"257"},"is_retracted":false,"is_paratext":false,"is_xpac":false,"primary_topic":{"id":"https://openalex.org/T10404","display_name":"Enzyme Catalysis and Immobilization","score":0.9991999864578247,"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"}},"topics":[{"id":"https://openalex.org/T10404","display_name":"Enzyme Catalysis and Immobilization","score":0.9991999864578247,"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"}},{"id":"https://openalex.org/T10211","display_name":"Computational Drug Discovery Methods","score":0.9980999827384949,"subfield":{"id":"https://openalex.org/subfields/1703","display_name":"Computational Theory and Mathematics"},"field":{"id":"https://openalex.org/fields/17","display_name":"Computer Science"},"domain":{"id":"https://openalex.org/domains/3","display_name":"Physical Sciences"}},{"id":"https://openalex.org/T10932","display_name":"Microbial Metabolic Engineering and Bioproduction","score":0.9976999759674072,"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/substrate","display_name":"Substrate (aquarium)","score":0.6690399050712585},{"id":"https://openalex.org/keywords/active-site","display_name":"Active site","score":0.6361712217330933},{"id":"https://openalex.org/keywords/chemistry","display_name":"Chemistry","score":0.5920344591140747},{"id":"https://openalex.org/keywords/combinatorial-chemistry","display_name":"Combinatorial chemistry","score":0.568930447101593},{"id":"https://openalex.org/keywords/enzyme","display_name":"Enzyme","score":0.5649774074554443},{"id":"https://openalex.org/keywords/amine-gas-treating","display_name":"Amine gas treating","score":0.5458396673202515},{"id":"https://openalex.org/keywords/stereochemistry","display_name":"Stereochemistry","score":0.5245288014411926},{"id":"https://openalex.org/keywords/docking","display_name":"Docking (animal)","score":0.5059344172477722},{"id":"https://openalex.org/keywords/virtual-screening","display_name":"Virtual screening","score":0.5052228569984436},{"id":"https://openalex.org/keywords/lipase","display_name":"Lipase","score":0.4136631190776825},{"id":"https://openalex.org/keywords/biochemistry","display_name":"Biochemistry","score":0.27617132663726807},{"id":"https://openalex.org/keywords/organic-chemistry","display_name":"Organic chemistry","score":0.2430848777294159},{"id":"https://openalex.org/keywords/pharmacophore","display_name":"Pharmacophore","score":0.1726953685283661},{"id":"https://openalex.org/keywords/biology","display_name":"Biology","score":0.12565135955810547}],"concepts":[{"id":"https://openalex.org/C2777289219","wikidata":"https://www.wikidata.org/wiki/Q7632154","display_name":"Substrate (aquarium)","level":2,"score":0.6690399050712585},{"id":"https://openalex.org/C41183919","wikidata":"https://www.wikidata.org/wiki/Q423026","display_name":"Active site","level":3,"score":0.6361712217330933},{"id":"https://openalex.org/C185592680","wikidata":"https://www.wikidata.org/wiki/Q2329","display_name":"Chemistry","level":0,"score":0.5920344591140747},{"id":"https://openalex.org/C21951064","wikidata":"https://www.wikidata.org/wiki/Q899212","display_name":"Combinatorial chemistry","level":1,"score":0.568930447101593},{"id":"https://openalex.org/C181199279","wikidata":"https://www.wikidata.org/wiki/Q8047","display_name":"Enzyme","level":2,"score":0.5649774074554443},{"id":"https://openalex.org/C131779359","wikidata":"https://www.wikidata.org/wiki/Q471875","display_name":"Amine gas treating","level":2,"score":0.5458396673202515},{"id":"https://openalex.org/C71240020","wikidata":"https://www.wikidata.org/wiki/Q186011","display_name":"Stereochemistry","level":1,"score":0.5245288014411926},{"id":"https://openalex.org/C41685203","wikidata":"https://www.wikidata.org/wiki/Q1974042","display_name":"Docking (animal)","level":2,"score":0.5059344172477722},{"id":"https://openalex.org/C103697762","wikidata":"https://www.wikidata.org/wiki/Q4112105","display_name":"Virtual screening","level":3,"score":0.5052228569984436},{"id":"https://openalex.org/C2779697368","wikidata":"https://www.wikidata.org/wiki/Q380967","display_name":"Lipase","level":3,"score":0.4136631190776825},{"id":"https://openalex.org/C55493867","wikidata":"https://www.wikidata.org/wiki/Q7094","display_name":"Biochemistry","level":1,"score":0.27617132663726807},{"id":"https://openalex.org/C178790620","wikidata":"https://www.wikidata.org/wiki/Q11351","display_name":"Organic chemistry","level":1,"score":0.2430848777294159},{"id":"https://openalex.org/C56173144","wikidata":"https://www.wikidata.org/wiki/Q1539893","display_name":"Pharmacophore","level":2,"score":0.1726953685283661},{"id":"https://openalex.org/C86803240","wikidata":"https://www.wikidata.org/wiki/Q420","display_name":"Biology","level":0,"score":0.12565135955810547},{"id":"https://openalex.org/C159110408","wikidata":"https://www.wikidata.org/wiki/Q121176","display_name":"Nursing","level":1,"score":0.0},{"id":"https://openalex.org/C18903297","wikidata":"https://www.wikidata.org/wiki/Q7150","display_name":"Ecology","level":1,"score":0.0},{"id":"https://openalex.org/C71924100","wikidata":"https://www.wikidata.org/wiki/Q11190","display_name":"Medicine","level":0,"score":0.0}],"mesh":[{"descriptor_ui":"D001665","descriptor_name":"Binding Sites","qualifier_ui":null,"qualifier_name":null,"is_major_topic":false},{"descriptor_ui":"D001665","descriptor_name":"Binding Sites","qualifier_ui":null,"qualifier_name":null,"is_major_topic":false},{"descriptor_ui":"D001665","descriptor_name":"Binding Sites","qualifier_ui":null,"qualifier_name":null,"is_major_topic":false},{"descriptor_ui":"D008024","descriptor_name":"Ligands","qualifier_ui":null,"qualifier_name":null,"is_major_topic":false},{"descriptor_ui":"D008024","descriptor_name":"Ligands","qualifier_ui":null,"qualifier_name":null,"is_major_topic":false},{"descriptor_ui":"D008024","descriptor_name":"Ligands","qualifier_ui":null,"qualifier_name":null,"is_major_topic":false},{"descriptor_ui":"D008958","descriptor_name":"Models, Molecular","qualifier_ui":null,"qualifier_name":null,"is_major_topic":false},{"descriptor_ui":"D008958","descriptor_name":"Models, Molecular","qualifier_ui":null,"qualifier_name":null,"is_major_topic":false},{"descriptor_ui":"D008958","descriptor_name":"Models, Molecular","qualifier_ui":null,"qualifier_name":null,"is_major_topic":false},{"descriptor_ui":"D011506","descriptor_name":"Proteins","qualifier_ui":"Q000378","qualifier_name":"metabolism","is_major_topic":false},{"descriptor_ui":"D011506","descriptor_name":"Proteins","qualifier_ui":"Q000378","qualifier_name":"metabolism","is_major_topic":false},{"descriptor_ui":"D011506","descriptor_name":"Proteins","qualifier_ui":"Q000378","qualifier_name":"metabolism","is_major_topic":false},{"descriptor_ui":"D011506","descriptor_name":"Proteins","qualifier_ui":"Q000737","qualifier_name":"chemistry","is_major_topic":false},{"descriptor_ui":"D011506","descriptor_name":"Proteins","qualifier_ui":"Q000737","qualifier_name":"chemistry","is_major_topic":false},{"descriptor_ui":"D011506","descriptor_name":"Proteins","qualifier_ui":"Q000737","qualifier_name":"chemistry","is_major_topic":false},{"descriptor_ui":"D013329","descriptor_name":"Structure-Activity Relationship","qualifier_ui":null,"qualifier_name":null,"is_major_topic":false},{"descriptor_ui":"D013329","descriptor_name":"Structure-Activity Relationship","qualifier_ui":null,"qualifier_name":null,"is_major_topic":false},{"descriptor_ui":"D013329","descriptor_name":"Structure-Activity Relationship","qualifier_ui":null,"qualifier_name":null,"is_major_topic":false},{"descriptor_ui":"D015195","descriptor_name":"Drug Design","qualifier_ui":null,"qualifier_name":null,"is_major_topic":true},{"descriptor_ui":"D015195","descriptor_name":"Drug Design","qualifier_ui":null,"qualifier_name":null,"is_major_topic":true},{"descriptor_ui":"D015195","descriptor_name":"Drug Design","qualifier_ui":null,"qualifier_name":null,"is_major_topic":true},{"descriptor_ui":"D019295","descriptor_name":"Computational Biology","qualifier_ui":"Q000379","qualifier_name":"methods","is_major_topic":false},{"descriptor_ui":"D019295","descriptor_name":"Computational Biology","qualifier_ui":"Q000379","qualifier_name":"methods","is_major_topic":false},{"descriptor_ui":"D019295","descriptor_name":"Computational Biology","qualifier_ui":"Q000379","qualifier_name":"methods","is_major_topic":false}],"locations_count":5,"locations":[{"id":"doi:10.1186/1471-2105-10-257","is_oa":true,"landing_page_url":"https://doi.org/10.1186/1471-2105-10-257","pdf_url":"https://bmcbioinformatics.biomedcentral.com/counter/pdf/10.1186/1471-2105-10-257","source":{"id":"https://openalex.org/S19032547","display_name":"BMC Bioinformatics","issn_l":"1471-2105","issn":["1471-2105"],"is_oa":true,"is_in_doaj":true,"is_core":true,"host_organization":"https://openalex.org/P4310320256","host_organization_name":"BioMed Central","host_organization_lineage":["https://openalex.org/P4310320256","https://openalex.org/P4310319965"],"host_organization_lineage_names":["BioMed Central","Springer Nature"],"type":"journal"},"license":"cc-by","license_id":"https://openalex.org/licenses/cc-by","version":"publishedVersion","is_accepted":true,"is_published":true,"raw_source_name":"BMC Bioinformatics","raw_type":"journal-article"},{"id":"pmid:19695105","is_oa":false,"landing_page_url":"https://pubmed.ncbi.nlm.nih.gov/19695105","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,"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":"BMC bioinformatics","raw_type":null},{"id":"pmh:oai:doaj.org/article:cd095463007545d38f36e624bf8d5c79","is_oa":true,"landing_page_url":"https://doaj.org/article/cd095463007545d38f36e624bf8d5c79","pdf_url":null,"source":{"id":"https://openalex.org/S112646816","display_name":"SHILAP Revista de lepidopterolog\u00eda","issn_l":"0300-5267","issn":["0300-5267","2340-4078"],"is_oa":true,"is_in_doaj":true,"is_core":false,"host_organization":null,"host_organization_name":null,"host_organization_lineage":[],"host_organization_lineage_names":[],"type":"journal"},"license":null,"license_id":null,"version":"submittedVersion","is_accepted":false,"is_published":false,"raw_source_name":"BMC Bioinformatics, Vol 10, Iss 1, p 257 (2009)","raw_type":"article"},{"id":"pmh:oai:pubmedcentral.nih.gov:2745390","is_oa":true,"landing_page_url":"https://www.ncbi.nlm.nih.gov/pmc/articles/2745390","pdf_url":null,"source":{"id":"https://openalex.org/S2764455111","display_name":"PubMed Central","issn_l":null,"issn":null,"is_oa":false,"is_in_doaj":false,"is_core":false,"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":"submittedVersion","is_accepted":false,"is_published":false,"raw_source_name":"BMC Bioinformatics","raw_type":"Text"},{"id":"pmh:oai:repository.rothamsted.ac.uk:8q404","is_oa":true,"landing_page_url":"https://dx.doi.org/10.1186/1471-2105-10-257","pdf_url":null,"source":{"id":"https://openalex.org/S4306402645","display_name":"Rothamsted Repository (Rothamsted Repository)","issn_l":null,"issn":null,"is_oa":false,"is_in_doaj":false,"is_core":false,"host_organization":"https://openalex.org/I2799553609","host_organization_name":"Rothamsted Research","host_organization_lineage":["https://openalex.org/I2799553609"],"host_organization_lineage_names":[],"type":"repository"},"license":"cc-by","license_id":"https://openalex.org/licenses/cc-by","version":"submittedVersion","is_accepted":false,"is_published":false,"raw_source_name":"","raw_type":"journal-article"}],"best_oa_location":{"id":"doi:10.1186/1471-2105-10-257","is_oa":true,"landing_page_url":"https://doi.org/10.1186/1471-2105-10-257","pdf_url":"https://bmcbioinformatics.biomedcentral.com/counter/pdf/10.1186/1471-2105-10-257","source":{"id":"https://openalex.org/S19032547","display_name":"BMC Bioinformatics","issn_l":"1471-2105","issn":["1471-2105"],"is_oa":true,"is_in_doaj":true,"is_core":true,"host_organization":"https://openalex.org/P4310320256","host_organization_name":"BioMed Central","host_organization_lineage":["https://openalex.org/P4310320256","https://openalex.org/P4310319965"],"host_organization_lineage_names":["BioMed Central","Springer Nature"],"type":"journal"},"license":"cc-by","license_id":"https://openalex.org/licenses/cc-by","version":"publishedVersion","is_accepted":true,"is_published":true,"raw_source_name":"BMC Bioinformatics","raw_type":"journal-article"},"sustainable_development_goals":[{"id":"https://metadata.un.org/sdg/4","score":0.44999998807907104,"display_name":"Quality Education"}],"awards":[{"id":"https://openalex.org/G1680505803","display_name":null,"funder_award_id":"2009CB724703","funder_id":"https://openalex.org/F4320335777","funder_display_name":"National Key Research and Development Program of China"},{"id":"https://openalex.org/G7129907147","display_name":null,"funder_award_id":"(973 Program","funder_id":"https://openalex.org/F4320335777","funder_display_name":"National Key Research and Development Program of China"}],"funders":[{"id":"https://openalex.org/F4320335777","display_name":"National Key Research and Development Program of China","ror":null}],"has_content":{"pdf":true,"grobid_xml":true},"content_urls":{"pdf":"https://content.openalex.org/works/W2080537348.pdf","grobid_xml":"https://content.openalex.org/works/W2080537348.grobid-xml"},"referenced_works_count":35,"referenced_works":["https://openalex.org/W1969631507","https://openalex.org/W1973792974","https://openalex.org/W1974772724","https://openalex.org/W1980942868","https://openalex.org/W1984237617","https://openalex.org/W1986240377","https://openalex.org/W1993418211","https://openalex.org/W2004315636","https://openalex.org/W2006200242","https://openalex.org/W2015775274","https://openalex.org/W2030841140","https://openalex.org/W2033495093","https://openalex.org/W2040124857","https://openalex.org/W2049492243","https://openalex.org/W2054285456","https://openalex.org/W2061545244","https://openalex.org/W2061776255","https://openalex.org/W2065784370","https://openalex.org/W2077343916","https://openalex.org/W2091734240","https://openalex.org/W2092934729","https://openalex.org/W2105900919","https://openalex.org/W2107506448","https://openalex.org/W2116499195","https://openalex.org/W2117094974","https://openalex.org/W2121895929","https://openalex.org/W2122962387","https://openalex.org/W2126729834","https://openalex.org/W2143696490","https://openalex.org/W2154662590","https://openalex.org/W2163167546","https://openalex.org/W2167041509","https://openalex.org/W2169872465","https://openalex.org/W2170773610","https://openalex.org/W2765021675"],"related_works":["https://openalex.org/W2359434416","https://openalex.org/W2094836748","https://openalex.org/W2381435079","https://openalex.org/W2773493604","https://openalex.org/W2269591907","https://openalex.org/W2027065525","https://openalex.org/W2057846043","https://openalex.org/W2336040088","https://openalex.org/W1977957906","https://openalex.org/W2004834660"],"abstract_inverted_index":{"The":[0],"idea":[1],"of":[2,10,26,35],"computer-aided":[3,36],"substrate":[4,37],"screening":[5],"is":[6,22],"a":[7],"creative":[8],"combination":[9],"computational":[11],"skills":[12],"and":[13],"enzymology.":[14],"Although":[15],"the":[16,27,33],"case":[17],"studied":[18],"in":[19],"this":[20],"paper":[21],"tentative,":[23],"high":[24],"accuracy":[25],"CASS":[28],"system":[29],"sheds":[30],"light":[31],"on":[32],"field":[34],"screening.":[38]},"counts_by_year":[{"year":2025,"cited_by_count":1},{"year":2021,"cited_by_count":1},{"year":2019,"cited_by_count":1},{"year":2017,"cited_by_count":1},{"year":2016,"cited_by_count":1},{"year":2015,"cited_by_count":1},{"year":2014,"cited_by_count":1},{"year":2013,"cited_by_count":4}],"updated_date":"2026-04-10T15:06:20.359241","created_date":"2025-10-10T00:00:00"}