{"id":"https://openalex.org/W1988338470","doi":"https://doi.org/10.1007/s10822-006-9076-9","title":"Balancing focused combinatorial libraries based on multiple GPCR ligands","display_name":"Balancing focused combinatorial libraries based on multiple GPCR ligands","publication_year":2006,"publication_date":"2006-10-12","ids":{"openalex":"https://openalex.org/W1988338470","doi":"https://doi.org/10.1007/s10822-006-9076-9","mag":"1988338470","pmid":"https://pubmed.ncbi.nlm.nih.gov/17054016"},"language":"en","primary_location":{"id":"doi:10.1007/s10822-006-9076-9","is_oa":false,"landing_page_url":"https://doi.org/10.1007/s10822-006-9076-9","pdf_url":null,"source":{"id":"https://openalex.org/S64621741","display_name":"Journal of Computer-Aided Molecular Design","issn_l":"0920-654X","issn":["0920-654X","1573-4951"],"is_oa":false,"is_in_doaj":false,"is_core":true,"host_organization":"https://openalex.org/P4310319900","host_organization_name":"Springer Science+Business Media","host_organization_lineage":["https://openalex.org/P4310319900","https://openalex.org/P4310319965"],"host_organization_lineage_names":["Springer Science+Business Media","Springer Nature"],"type":"journal"},"license":null,"license_id":null,"version":"publishedVersion","is_accepted":true,"is_published":true,"raw_source_name":"Journal of Computer-Aided Molecular Design","raw_type":"journal-article"},"type":"article","indexed_in":["crossref","pubmed"],"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/A5085470555","display_name":"Farhad Soltanshahi","orcid":null},"institutions":[],"countries":[],"is_corresponding":true,"raw_author_name":"Farhad Soltanshahi","raw_affiliation_strings":["Informatics Research Center, Tripos, Inc., 1699 S. Hanley Road, St Louis, MO 63144, USA","Tripos, Inc"],"affiliations":[{"raw_affiliation_string":"Informatics Research Center, Tripos, Inc., 1699 S. Hanley Road, St Louis, MO 63144, USA","institution_ids":[]},{"raw_affiliation_string":"Tripos, Inc","institution_ids":[]}]},{"author_position":"middle","author":{"id":"https://openalex.org/A5069544241","display_name":"Tamsin E. Mansley","orcid":null},"institutions":[],"countries":[],"is_corresponding":false,"raw_author_name":"Tamsin E. Mansley","raw_affiliation_strings":["Informatics Research Center, Tripos, Inc., 1699 S. Hanley Road, St Louis, MO, 63144, USA","Tripos, Inc"],"affiliations":[{"raw_affiliation_string":"Informatics Research Center, Tripos, Inc., 1699 S. Hanley Road, St Louis, MO, 63144, USA","institution_ids":[]},{"raw_affiliation_string":"Tripos, Inc","institution_ids":[]}]},{"author_position":"middle","author":{"id":"https://openalex.org/A5016220974","display_name":"Sun Choi","orcid":"https://orcid.org/0000-0002-7669-7954"},"institutions":[{"id":"https://openalex.org/I4210132203","display_name":"Ewha Womans University Medical Center","ror":"https://ror.org/03exgrk66","country_code":"KR","type":"healthcare","lineage":["https://openalex.org/I138925566","https://openalex.org/I4210132203"]}],"countries":["KR"],"is_corresponding":false,"raw_author_name":"Sun Choi","raw_affiliation_strings":["Informatics Research Center, Tripos, Inc., 1699 S. Hanley Road, St Louis, MO, 63144, USA","Ewha Womans University"],"affiliations":[{"raw_affiliation_string":"Informatics Research Center, Tripos, Inc., 1699 S. Hanley Road, St Louis, MO, 63144, USA","institution_ids":[]},{"raw_affiliation_string":"Ewha Womans University","institution_ids":["https://openalex.org/I4210132203"]}]},{"author_position":"last","author":{"id":"https://openalex.org/A5048661632","display_name":"Robert D. Clark","orcid":"https://orcid.org/0000-0001-9509-8132"},"institutions":[],"countries":[],"is_corresponding":false,"raw_author_name":"Robert D. Clark","raw_affiliation_strings":["Informatics Research Center, Tripos, Inc., 1699 S. Hanley Road, St Louis, MO, 63144, USA","Tripos, Inc"],"affiliations":[{"raw_affiliation_string":"Informatics Research Center, Tripos, Inc., 1699 S. Hanley Road, St Louis, MO, 63144, USA","institution_ids":[]},{"raw_affiliation_string":"Tripos, Inc","institution_ids":[]}]}],"institutions":[],"countries_distinct_count":1,"institutions_distinct_count":4,"corresponding_author_ids":["https://openalex.org/A5085470555"],"corresponding_institution_ids":[],"apc_list":{"value":2890,"currency":"EUR","value_usd":3690},"apc_paid":null,"fwci":0.4063,"has_fulltext":false,"cited_by_count":11,"citation_normalized_percentile":{"value":0.60170062,"is_in_top_1_percent":false,"is_in_top_10_percent":false},"cited_by_percentile_year":{"min":89,"max":94},"biblio":{"volume":"20","issue":"7-8","first_page":"529","last_page":"538"},"is_retracted":false,"is_paratext":false,"is_xpac":false,"primary_topic":{"id":"https://openalex.org/T11178","display_name":"Receptor Mechanisms and Signaling","score":0.9994999766349792,"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/T11178","display_name":"Receptor Mechanisms and Signaling","score":0.9994999766349792,"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/T10911","display_name":"Chemical Synthesis and Analysis","score":0.9993000030517578,"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/T11016","display_name":"Monoclonal and Polyclonal Antibodies Research","score":0.9986000061035156,"subfield":{"id":"https://openalex.org/subfields/2741","display_name":"Radiology, Nuclear Medicine and Imaging"},"field":{"id":"https://openalex.org/fields/27","display_name":"Medicine"},"domain":{"id":"https://openalex.org/domains/4","display_name":"Health Sciences"}}],"keywords":[{"id":"https://openalex.org/keywords/computer-science","display_name":"Computer science","score":0.7174261808395386},{"id":"https://openalex.org/keywords/g-protein-coupled-receptor","display_name":"G protein-coupled receptor","score":0.6858810186386108},{"id":"https://openalex.org/keywords/matching","display_name":"Matching (statistics)","score":0.5092226266860962},{"id":"https://openalex.org/keywords/drug-discovery","display_name":"Drug discovery","score":0.504304051399231},{"id":"https://openalex.org/keywords/modularity","display_name":"Modularity (biology)","score":0.4328002333641052},{"id":"https://openalex.org/keywords/computational-biology","display_name":"Computational biology","score":0.4132833480834961},{"id":"https://openalex.org/keywords/combinatorial-chemistry","display_name":"Combinatorial chemistry","score":0.33863821625709534},{"id":"https://openalex.org/keywords/chemistry","display_name":"Chemistry","score":0.2535858154296875},{"id":"https://openalex.org/keywords/bioinformatics","display_name":"Bioinformatics","score":0.1900193691253662},{"id":"https://openalex.org/keywords/biology","display_name":"Biology","score":0.13671740889549255},{"id":"https://openalex.org/keywords/receptor","display_name":"Receptor","score":0.11327651143074036},{"id":"https://openalex.org/keywords/mathematics","display_name":"Mathematics","score":0.10408437252044678}],"concepts":[{"id":"https://openalex.org/C41008148","wikidata":"https://www.wikidata.org/wiki/Q21198","display_name":"Computer science","level":0,"score":0.7174261808395386},{"id":"https://openalex.org/C135285700","wikidata":"https://www.wikidata.org/wiki/Q38173","display_name":"G protein-coupled receptor","level":3,"score":0.6858810186386108},{"id":"https://openalex.org/C165064840","wikidata":"https://www.wikidata.org/wiki/Q1321061","display_name":"Matching (statistics)","level":2,"score":0.5092226266860962},{"id":"https://openalex.org/C74187038","wikidata":"https://www.wikidata.org/wiki/Q1418791","display_name":"Drug discovery","level":2,"score":0.504304051399231},{"id":"https://openalex.org/C2779478453","wikidata":"https://www.wikidata.org/wiki/Q6889748","display_name":"Modularity (biology)","level":2,"score":0.4328002333641052},{"id":"https://openalex.org/C70721500","wikidata":"https://www.wikidata.org/wiki/Q177005","display_name":"Computational biology","level":1,"score":0.4132833480834961},{"id":"https://openalex.org/C21951064","wikidata":"https://www.wikidata.org/wiki/Q899212","display_name":"Combinatorial chemistry","level":1,"score":0.33863821625709534},{"id":"https://openalex.org/C185592680","wikidata":"https://www.wikidata.org/wiki/Q2329","display_name":"Chemistry","level":0,"score":0.2535858154296875},{"id":"https://openalex.org/C60644358","wikidata":"https://www.wikidata.org/wiki/Q128570","display_name":"Bioinformatics","level":1,"score":0.1900193691253662},{"id":"https://openalex.org/C86803240","wikidata":"https://www.wikidata.org/wiki/Q420","display_name":"Biology","level":0,"score":0.13671740889549255},{"id":"https://openalex.org/C170493617","wikidata":"https://www.wikidata.org/wiki/Q208467","display_name":"Receptor","level":2,"score":0.11327651143074036},{"id":"https://openalex.org/C33923547","wikidata":"https://www.wikidata.org/wiki/Q395","display_name":"Mathematics","level":0,"score":0.10408437252044678},{"id":"https://openalex.org/C54355233","wikidata":"https://www.wikidata.org/wiki/Q7162","display_name":"Genetics","level":1,"score":0.0},{"id":"https://openalex.org/C55493867","wikidata":"https://www.wikidata.org/wiki/Q7094","display_name":"Biochemistry","level":1,"score":0.0},{"id":"https://openalex.org/C105795698","wikidata":"https://www.wikidata.org/wiki/Q12483","display_name":"Statistics","level":1,"score":0.0}],"mesh":[{"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":"D012984","descriptor_name":"Software","qualifier_ui":null,"qualifier_name":null,"is_major_topic":false},{"descriptor_ui":"D012984","descriptor_name":"Software","qualifier_ui":null,"qualifier_name":null,"is_major_topic":false},{"descriptor_ui":"D012984","descriptor_name":"Software","qualifier_ui":null,"qualifier_name":null,"is_major_topic":false},{"descriptor_ui":"D019707","descriptor_name":"Receptors, Chemokine","qualifier_ui":"Q000037","qualifier_name":"antagonists & inhibitors","is_major_topic":false},{"descriptor_ui":"D019707","descriptor_name":"Receptors, Chemokine","qualifier_ui":"Q000037","qualifier_name":"antagonists & inhibitors","is_major_topic":false},{"descriptor_ui":"D019707","descriptor_name":"Receptors, Chemokine","qualifier_ui":"Q000037","qualifier_name":"antagonists & inhibitors","is_major_topic":false},{"descriptor_ui":"D019707","descriptor_name":"Receptors, Chemokine","qualifier_ui":"Q000378","qualifier_name":"metabolism","is_major_topic":false},{"descriptor_ui":"D019707","descriptor_name":"Receptors, Chemokine","qualifier_ui":"Q000378","qualifier_name":"metabolism","is_major_topic":false},{"descriptor_ui":"D019707","descriptor_name":"Receptors, Chemokine","qualifier_ui":"Q000378","qualifier_name":"metabolism","is_major_topic":false},{"descriptor_ui":"D020650","descriptor_name":"Combinatorial Chemistry Techniques","qualifier_ui":null,"qualifier_name":null,"is_major_topic":true},{"descriptor_ui":"D020650","descriptor_name":"Combinatorial Chemistry Techniques","qualifier_ui":null,"qualifier_name":null,"is_major_topic":true},{"descriptor_ui":"D020650","descriptor_name":"Combinatorial Chemistry Techniques","qualifier_ui":null,"qualifier_name":null,"is_major_topic":true},{"descriptor_ui":"D043562","descriptor_name":"Receptors, G-Protein-Coupled","qualifier_ui":"Q000378","qualifier_name":"metabolism","is_major_topic":false},{"descriptor_ui":"D043562","descriptor_name":"Receptors, G-Protein-Coupled","qualifier_ui":"Q000378","qualifier_name":"metabolism","is_major_topic":false},{"descriptor_ui":"D043562","descriptor_name":"Receptors, G-Protein-Coupled","qualifier_ui":"Q000378","qualifier_name":"metabolism","is_major_topic":false},{"descriptor_ui":"D043562","descriptor_name":"Receptors, G-Protein-Coupled","qualifier_ui":"Q000737","qualifier_name":"chemistry","is_major_topic":false},{"descriptor_ui":"D043562","descriptor_name":"Receptors, G-Protein-Coupled","qualifier_ui":"Q000737","qualifier_name":"chemistry","is_major_topic":false},{"descriptor_ui":"D043562","descriptor_name":"Receptors, G-Protein-Coupled","qualifier_ui":"Q000737","qualifier_name":"chemistry","is_major_topic":false},{"descriptor_ui":"D044263","descriptor_name":"Receptors, Serotonin, 5-HT1","qualifier_ui":"Q000378","qualifier_name":"metabolism","is_major_topic":false},{"descriptor_ui":"D044263","descriptor_name":"Receptors, Serotonin, 5-HT1","qualifier_ui":"Q000378","qualifier_name":"metabolism","is_major_topic":false},{"descriptor_ui":"D044263","descriptor_name":"Receptors, Serotonin, 5-HT1","qualifier_ui":"Q000378","qualifier_name":"metabolism","is_major_topic":false},{"descriptor_ui":"D054389","descriptor_name":"Receptors, CCR1","qualifier_ui":null,"qualifier_name":null,"is_major_topic":false},{"descriptor_ui":"D054389","descriptor_name":"Receptors, CCR1","qualifier_ui":null,"qualifier_name":null,"is_major_topic":false},{"descriptor_ui":"D054389","descriptor_name":"Receptors, CCR1","qualifier_ui":null,"qualifier_name":null,"is_major_topic":false},{"descriptor_ui":"D058825","descriptor_name":"Serotonin 5-HT1 Receptor Agonists","qualifier_ui":null,"qualifier_name":null,"is_major_topic":false},{"descriptor_ui":"D058825","descriptor_name":"Serotonin 5-HT1 Receptor Agonists","qualifier_ui":null,"qualifier_name":null,"is_major_topic":false},{"descriptor_ui":"D058825","descriptor_name":"Serotonin 5-HT1 Receptor Agonists","qualifier_ui":null,"qualifier_name":null,"is_major_topic":false}],"locations_count":2,"locations":[{"id":"doi:10.1007/s10822-006-9076-9","is_oa":false,"landing_page_url":"https://doi.org/10.1007/s10822-006-9076-9","pdf_url":null,"source":{"id":"https://openalex.org/S64621741","display_name":"Journal of Computer-Aided Molecular Design","issn_l":"0920-654X","issn":["0920-654X","1573-4951"],"is_oa":false,"is_in_doaj":false,"is_core":true,"host_organization":"https://openalex.org/P4310319900","host_organization_name":"Springer Science+Business Media","host_organization_lineage":["https://openalex.org/P4310319900","https://openalex.org/P4310319965"],"host_organization_lineage_names":["Springer Science+Business Media","Springer Nature"],"type":"journal"},"license":null,"license_id":null,"version":"publishedVersion","is_accepted":true,"is_published":true,"raw_source_name":"Journal of Computer-Aided Molecular Design","raw_type":"journal-article"},{"id":"pmid:17054016","is_oa":false,"landing_page_url":"https://pubmed.ncbi.nlm.nih.gov/17054016","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":"Journal of computer-aided molecular design","raw_type":null}],"best_oa_location":null,"sustainable_development_goals":[{"score":0.46000000834465027,"display_name":"Good health and well-being","id":"https://metadata.un.org/sdg/3"}],"awards":[],"funders":[],"has_content":{"grobid_xml":false,"pdf":false},"content_urls":null,"referenced_works_count":23,"referenced_works":["https://openalex.org/W1965972974","https://openalex.org/W1969524352","https://openalex.org/W1987952795","https://openalex.org/W2004608921","https://openalex.org/W2012943500","https://openalex.org/W2021083597","https://openalex.org/W2057053589","https://openalex.org/W2063331957","https://openalex.org/W2067093847","https://openalex.org/W2088372218","https://openalex.org/W2088387982","https://openalex.org/W2092302310","https://openalex.org/W2095251337","https://openalex.org/W2097362827","https://openalex.org/W2135732933","https://openalex.org/W2149963584","https://openalex.org/W2155580702","https://openalex.org/W2199408702","https://openalex.org/W2411664177","https://openalex.org/W2419154070","https://openalex.org/W2951811035","https://openalex.org/W3106476329","https://openalex.org/W4248107770"],"related_works":["https://openalex.org/W4230687177","https://openalex.org/W1968829728","https://openalex.org/W2349859869","https://openalex.org/W2051365847","https://openalex.org/W2367249529","https://openalex.org/W2609050007","https://openalex.org/W3120118008","https://openalex.org/W1981292198","https://openalex.org/W1135792216","https://openalex.org/W2177786495"],"abstract_inverted_index":null,"counts_by_year":[{"year":2021,"cited_by_count":1},{"year":2014,"cited_by_count":1}],"updated_date":"2026-01-13T01:12:25.745995","created_date":"2025-10-10T00:00:00"}
