{"id":"https://openalex.org/W4318817523","doi":"https://doi.org/10.1002/aisy.202200243","title":"The Rise of Machine Learning in Polymer Discovery","display_name":"The Rise of Machine Learning in Polymer Discovery","publication_year":2023,"publication_date":"2023-01-31","ids":{"openalex":"https://openalex.org/W4318817523","doi":"https://doi.org/10.1002/aisy.202200243"},"language":"en","primary_location":{"id":"doi:10.1002/aisy.202200243","is_oa":true,"landing_page_url":"https://doi.org/10.1002/aisy.202200243","pdf_url":"https://onlinelibrary.wiley.com/doi/pdfdirect/10.1002/aisy.202200243","source":{"id":"https://openalex.org/S4210212817","display_name":"Advanced Intelligent Systems","issn_l":"2640-4567","issn":["2640-4567"],"is_oa":true,"is_in_doaj":true,"is_core":true,"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":"Advanced Intelligent Systems","raw_type":"journal-article"},"type":"article","indexed_in":["crossref","doaj"],"open_access":{"is_oa":true,"oa_status":"gold","oa_url":"https://onlinelibrary.wiley.com/doi/pdfdirect/10.1002/aisy.202200243","any_repository_has_fulltext":true},"authorships":[{"author_position":"first","author":{"id":"https://openalex.org/A5100391295","display_name":"Cheng Yan","orcid":"https://orcid.org/0000-0002-7567-0522"},"institutions":[{"id":"https://openalex.org/I121820613","display_name":"Louisiana State University","ror":"https://ror.org/05ect4e57","country_code":"US","type":"education","lineage":["https://openalex.org/I121820613"]},{"id":"https://openalex.org/I145610796","display_name":"Southern University and Agricultural and Mechanical College","ror":"https://ror.org/04r3m2882","country_code":"US","type":"education","lineage":["https://openalex.org/I145610796"]}],"countries":["US"],"is_corresponding":false,"raw_author_name":"Cheng Yan","raw_affiliation_strings":["Department of Mechanical & Industrial Engineering Louisiana State University  Baton Rouge LA 70803 USA","Department of Mechanical Engineering Southern University and A&M College  Baton Rouge LA 70813 USA","Department of Mechanical & Industrial Engineering, Louisiana State University, Baton Rouge, LA, 70803 USA","Department of Mechanical Engineering, Southern University and A&M College, Baton Rouge, LA, 70813 USA"],"raw_orcid":null,"affiliations":[{"raw_affiliation_string":"Department of Mechanical & Industrial Engineering Louisiana State University  Baton Rouge LA 70803 USA","institution_ids":["https://openalex.org/I121820613"]},{"raw_affiliation_string":"Department of Mechanical Engineering Southern University and A&M College  Baton Rouge LA 70813 USA","institution_ids":["https://openalex.org/I145610796"]},{"raw_affiliation_string":"Department of Mechanical & Industrial Engineering, Louisiana State University, Baton Rouge, LA, 70803 USA","institution_ids":["https://openalex.org/I121820613"]},{"raw_affiliation_string":"Department of Mechanical Engineering, Southern University and A&M College, Baton Rouge, LA, 70813 USA","institution_ids":["https://openalex.org/I145610796"]}]},{"author_position":"last","author":{"id":"https://openalex.org/A5100354154","display_name":"Guoqiang Li","orcid":"https://orcid.org/0000-0002-7004-6659"},"institutions":[{"id":"https://openalex.org/I121820613","display_name":"Louisiana State University","ror":"https://ror.org/05ect4e57","country_code":"US","type":"education","lineage":["https://openalex.org/I121820613"]}],"countries":["US"],"is_corresponding":true,"raw_author_name":"Guoqiang Li","raw_affiliation_strings":["Department of Mechanical & Industrial Engineering Louisiana State University  Baton Rouge LA 70803 USA","Department of Mechanical & Industrial Engineering, Louisiana State University, Baton Rouge, LA, 70803 USA"],"raw_orcid":"https://orcid.org/0000-0002-7004-6659","affiliations":[{"raw_affiliation_string":"Department of Mechanical & Industrial Engineering Louisiana State University  Baton Rouge LA 70803 USA","institution_ids":["https://openalex.org/I121820613"]},{"raw_affiliation_string":"Department of Mechanical & Industrial Engineering, Louisiana State University, Baton Rouge, LA, 70803 USA","institution_ids":["https://openalex.org/I121820613"]}]}],"institutions":[],"countries_distinct_count":1,"institutions_distinct_count":2,"corresponding_author_ids":["https://openalex.org/A5100354154"],"corresponding_institution_ids":["https://openalex.org/I121820613"],"apc_list":{"value":2750,"currency":"USD","value_usd":2750},"apc_paid":{"value":2750,"currency":"USD","value_usd":2750},"fwci":6.5498,"has_fulltext":true,"cited_by_count":86,"citation_normalized_percentile":{"value":0.98254607,"is_in_top_1_percent":false,"is_in_top_10_percent":true},"cited_by_percentile_year":{"min":99,"max":100},"biblio":{"volume":"5","issue":"4","first_page":null,"last_page":null},"is_retracted":false,"is_paratext":false,"is_xpac":false,"primary_topic":{"id":"https://openalex.org/T11948","display_name":"Machine Learning in Materials Science","score":0.9986000061035156,"subfield":{"id":"https://openalex.org/subfields/2505","display_name":"Materials Chemistry"},"field":{"id":"https://openalex.org/fields/25","display_name":"Materials Science"},"domain":{"id":"https://openalex.org/domains/3","display_name":"Physical Sciences"}},"topics":[{"id":"https://openalex.org/T11948","display_name":"Machine Learning in Materials Science","score":0.9986000061035156,"subfield":{"id":"https://openalex.org/subfields/2505","display_name":"Materials Chemistry"},"field":{"id":"https://openalex.org/fields/25","display_name":"Materials Science"},"domain":{"id":"https://openalex.org/domains/3","display_name":"Physical Sciences"}},{"id":"https://openalex.org/T10211","display_name":"Computational Drug Discovery Methods","score":0.996399998664856,"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/T10836","display_name":"Metabolomics and Mass Spectrometry Studies","score":0.986299991607666,"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/business-process-discovery","display_name":"Business process discovery","score":0.6530730724334717},{"id":"https://openalex.org/keywords/process","display_name":"Process (computing)","score":0.6422383189201355},{"id":"https://openalex.org/keywords/field","display_name":"Field (mathematics)","score":0.6266932487487793},{"id":"https://openalex.org/keywords/computer-science","display_name":"Computer science","score":0.6137159466743469},{"id":"https://openalex.org/keywords/selection","display_name":"Selection (genetic algorithm)","score":0.5096874237060547},{"id":"https://openalex.org/keywords/data-science","display_name":"Data science","score":0.4684213399887085},{"id":"https://openalex.org/keywords/service-discovery","display_name":"Service discovery","score":0.4198019504547119},{"id":"https://openalex.org/keywords/artificial-intelligence","display_name":"Artificial intelligence","score":0.39824533462524414},{"id":"https://openalex.org/keywords/machine-learning","display_name":"Machine learning","score":0.3613944947719574},{"id":"https://openalex.org/keywords/engineering","display_name":"Engineering","score":0.24729976058006287},{"id":"https://openalex.org/keywords/work-in-process","display_name":"Work in process","score":0.2249392569065094},{"id":"https://openalex.org/keywords/world-wide-web","display_name":"World Wide Web","score":0.11998230218887329},{"id":"https://openalex.org/keywords/web-service","display_name":"Web service","score":0.1091298758983612},{"id":"https://openalex.org/keywords/mathematics","display_name":"Mathematics","score":0.07026895880699158},{"id":"https://openalex.org/keywords/operations-management","display_name":"Operations management","score":0.059880226850509644}],"concepts":[{"id":"https://openalex.org/C93453677","wikidata":"https://www.wikidata.org/wiki/Q1017580","display_name":"Business process discovery","level":5,"score":0.6530730724334717},{"id":"https://openalex.org/C98045186","wikidata":"https://www.wikidata.org/wiki/Q205663","display_name":"Process (computing)","level":2,"score":0.6422383189201355},{"id":"https://openalex.org/C9652623","wikidata":"https://www.wikidata.org/wiki/Q190109","display_name":"Field (mathematics)","level":2,"score":0.6266932487487793},{"id":"https://openalex.org/C41008148","wikidata":"https://www.wikidata.org/wiki/Q21198","display_name":"Computer science","level":0,"score":0.6137159466743469},{"id":"https://openalex.org/C81917197","wikidata":"https://www.wikidata.org/wiki/Q628760","display_name":"Selection (genetic algorithm)","level":2,"score":0.5096874237060547},{"id":"https://openalex.org/C2522767166","wikidata":"https://www.wikidata.org/wiki/Q2374463","display_name":"Data science","level":1,"score":0.4684213399887085},{"id":"https://openalex.org/C144097018","wikidata":"https://www.wikidata.org/wiki/Q4329404","display_name":"Service discovery","level":3,"score":0.4198019504547119},{"id":"https://openalex.org/C154945302","wikidata":"https://www.wikidata.org/wiki/Q11660","display_name":"Artificial intelligence","level":1,"score":0.39824533462524414},{"id":"https://openalex.org/C119857082","wikidata":"https://www.wikidata.org/wiki/Q2539","display_name":"Machine learning","level":1,"score":0.3613944947719574},{"id":"https://openalex.org/C127413603","wikidata":"https://www.wikidata.org/wiki/Q11023","display_name":"Engineering","level":0,"score":0.24729976058006287},{"id":"https://openalex.org/C174998907","wikidata":"https://www.wikidata.org/wiki/Q357662","display_name":"Work in process","level":2,"score":0.2249392569065094},{"id":"https://openalex.org/C136764020","wikidata":"https://www.wikidata.org/wiki/Q466","display_name":"World Wide Web","level":1,"score":0.11998230218887329},{"id":"https://openalex.org/C35578498","wikidata":"https://www.wikidata.org/wiki/Q193424","display_name":"Web service","level":2,"score":0.1091298758983612},{"id":"https://openalex.org/C33923547","wikidata":"https://www.wikidata.org/wiki/Q395","display_name":"Mathematics","level":0,"score":0.07026895880699158},{"id":"https://openalex.org/C21547014","wikidata":"https://www.wikidata.org/wiki/Q1423657","display_name":"Operations management","level":1,"score":0.059880226850509644},{"id":"https://openalex.org/C202444582","wikidata":"https://www.wikidata.org/wiki/Q837863","display_name":"Pure mathematics","level":1,"score":0.0},{"id":"https://openalex.org/C207505557","wikidata":"https://www.wikidata.org/wiki/Q4374012","display_name":"Business process modeling","level":4,"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/C85345410","wikidata":"https://www.wikidata.org/wiki/Q851587","display_name":"Business process","level":3,"score":0.0}],"mesh":[],"locations_count":3,"locations":[{"id":"doi:10.1002/aisy.202200243","is_oa":true,"landing_page_url":"https://doi.org/10.1002/aisy.202200243","pdf_url":"https://onlinelibrary.wiley.com/doi/pdfdirect/10.1002/aisy.202200243","source":{"id":"https://openalex.org/S4210212817","display_name":"Advanced Intelligent Systems","issn_l":"2640-4567","issn":["2640-4567"],"is_oa":true,"is_in_doaj":true,"is_core":true,"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":"Advanced Intelligent Systems","raw_type":"journal-article"},{"id":"pmh:oai:repository.lsu.edu:mechanical_engineering_pubs-2542","is_oa":true,"landing_page_url":"https://repository.lsu.edu/mechanical_engineering_pubs/1542","pdf_url":null,"source":{"id":"https://openalex.org/S4210169993","display_name":"Civil War Book Review","issn_l":"1528-6592","issn":["1528-6592"],"is_oa":true,"is_in_doaj":false,"is_core":false,"host_organization":"https://openalex.org/P4310315936","host_organization_name":"Louisiana State University","host_organization_lineage":["https://openalex.org/P4310315936"],"host_organization_lineage_names":["Louisiana State University"],"type":"journal"},"license":null,"license_id":null,"version":"submittedVersion","is_accepted":false,"is_published":false,"raw_source_name":"Faculty Publications","raw_type":"text"},{"id":"pmh:oai:doaj.org/article:5576f0192a7147da887ebee23f94a903","is_oa":true,"landing_page_url":"https://doaj.org/article/5576f0192a7147da887ebee23f94a903","pdf_url":null,"source":{"id":"https://openalex.org/S4306401280","display_name":"DOAJ (DOAJ: Directory of Open Access Journals)","issn_l":null,"issn":null,"is_oa":false,"is_in_doaj":false,"is_core":false,"host_organization":null,"host_organization_name":null,"host_organization_lineage":[],"host_organization_lineage_names":[],"type":"repository"},"license":"cc-by-sa","license_id":"https://openalex.org/licenses/cc-by-sa","version":"submittedVersion","is_accepted":false,"is_published":false,"raw_source_name":"Advanced Intelligent Systems, Vol 5, Iss 4, Pp n/a-n/a (2023)","raw_type":"article"}],"best_oa_location":{"id":"doi:10.1002/aisy.202200243","is_oa":true,"landing_page_url":"https://doi.org/10.1002/aisy.202200243","pdf_url":"https://onlinelibrary.wiley.com/doi/pdfdirect/10.1002/aisy.202200243","source":{"id":"https://openalex.org/S4210212817","display_name":"Advanced Intelligent Systems","issn_l":"2640-4567","issn":["2640-4567"],"is_oa":true,"is_in_doaj":true,"is_core":true,"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":"Advanced Intelligent Systems","raw_type":"journal-article"},"sustainable_development_goals":[],"awards":[{"id":"https://openalex.org/G2361280647","display_name":"CREST Center for Next Generation Multifunctional Composites (NextGen Composites Phase II)","funder_award_id":"1736136","funder_id":"https://openalex.org/F4320306076","funder_display_name":"National Science Foundation"},{"id":"https://openalex.org/G3215833910","display_name":null,"funder_award_id":"-1946231","funder_id":"https://openalex.org/F4320306076","funder_display_name":"National Science Foundation"},{"id":"https://openalex.org/G4439180760","display_name":"RII Track-1: Louisiana Materials Design Alliance (LAMDA)","funder_award_id":"1946231","funder_id":"https://openalex.org/F4320306076","funder_display_name":"National Science Foundation"},{"id":"https://openalex.org/G671402997","display_name":null,"funder_award_id":"OIA-1946231","funder_id":"https://openalex.org/F4320306076","funder_display_name":"National Science Foundation"},{"id":"https://openalex.org/G6731837354","display_name":null,"funder_award_id":"HRD\u20101736136","funder_id":"https://openalex.org/F4320306076","funder_display_name":"National Science Foundation"},{"id":"https://openalex.org/G7265765185","display_name":null,"funder_award_id":"OIA-1946231","funder_id":"https://openalex.org/F4320309392","funder_display_name":"Louisiana Board of Regents"},{"id":"https://openalex.org/G8925239685","display_name":null,"funder_award_id":"HRD-1736136","funder_id":"https://openalex.org/F4320306076","funder_display_name":"National Science Foundation"}],"funders":[{"id":"https://openalex.org/F4320306076","display_name":"National Science Foundation","ror":"https://ror.org/021nxhr62"},{"id":"https://openalex.org/F4320309392","display_name":"Louisiana Board of Regents","ror":"https://ror.org/00jv89z46"}],"has_content":{"grobid_xml":false,"pdf":true},"content_urls":{"pdf":"https://content.openalex.org/works/W4318817523.pdf"},"referenced_works_count":105,"referenced_works":["https://openalex.org/W1498436455","https://openalex.org/W1513260206","https://openalex.org/W1630082356","https://openalex.org/W1969354909","https://openalex.org/W1975147762","https://openalex.org/W1978159078","https://openalex.org/W1978639115","https://openalex.org/W1983452442","https://openalex.org/W1988037271","https://openalex.org/W2017741151","https://openalex.org/W2038702914","https://openalex.org/W2041146183","https://openalex.org/W2064675550","https://openalex.org/W2068110511","https://openalex.org/W2072176087","https://openalex.org/W2101926813","https://openalex.org/W2147800946","https://openalex.org/W2163487718","https://openalex.org/W2261676784","https://openalex.org/W2291908932","https://openalex.org/W2415372084","https://openalex.org/W2416928936","https://openalex.org/W2529996553","https://openalex.org/W2565684601","https://openalex.org/W2587394097","https://openalex.org/W2592262780","https://openalex.org/W2754122850","https://openalex.org/W2766362701","https://openalex.org/W2798741797","https://openalex.org/W2806061811","https://openalex.org/W2883528235","https://openalex.org/W2883583109","https://openalex.org/W2909240409","https://openalex.org/W2938365887","https://openalex.org/W2945206293","https://openalex.org/W2945892680","https://openalex.org/W2952832141","https://openalex.org/W2963310136","https://openalex.org/W2963731249","https://openalex.org/W2972505724","https://openalex.org/W2972859068","https://openalex.org/W2973074478","https://openalex.org/W2984886967","https://openalex.org/W2985931096","https://openalex.org/W2991736596","https://openalex.org/W2994786560","https://openalex.org/W2995884357","https://openalex.org/W2996697800","https://openalex.org/W2999720477","https://openalex.org/W3010244463","https://openalex.org/W3011801711","https://openalex.org/W3022297025","https://openalex.org/W3024556032","https://openalex.org/W3033201772","https://openalex.org/W3045522182","https://openalex.org/W3048884198","https://openalex.org/W3083033135","https://openalex.org/W3085104379","https://openalex.org/W3091459767","https://openalex.org/W3092743582","https://openalex.org/W3093821973","https://openalex.org/W3096386116","https://openalex.org/W3099763033","https://openalex.org/W3100537819","https://openalex.org/W3105363829","https://openalex.org/W3108967272","https://openalex.org/W3109043226","https://openalex.org/W3110641297","https://openalex.org/W3111189094","https://openalex.org/W3112510144","https://openalex.org/W3113066875","https://openalex.org/W3114168740","https://openalex.org/W3118124377","https://openalex.org/W3124518511","https://openalex.org/W3124798911","https://openalex.org/W3125983160","https://openalex.org/W3129084747","https://openalex.org/W3129764520","https://openalex.org/W3133138009","https://openalex.org/W3142188241","https://openalex.org/W3156578609","https://openalex.org/W3158860966","https://openalex.org/W3159638831","https://openalex.org/W3176193204","https://openalex.org/W3197690017","https://openalex.org/W3198350258","https://openalex.org/W3206309200","https://openalex.org/W3207749172","https://openalex.org/W3210772514","https://openalex.org/W4200001045","https://openalex.org/W4200261085","https://openalex.org/W4200608739","https://openalex.org/W4205095678","https://openalex.org/W4205961095","https://openalex.org/W4206946030","https://openalex.org/W4206948934","https://openalex.org/W4211041253","https://openalex.org/W4211182742","https://openalex.org/W4220989818","https://openalex.org/W4229451304","https://openalex.org/W4280520926","https://openalex.org/W4280529368","https://openalex.org/W4283463809","https://openalex.org/W4285745047","https://openalex.org/W4293232267"],"related_works":["https://openalex.org/W2616189383","https://openalex.org/W2115180690","https://openalex.org/W2550799892","https://openalex.org/W2149954094","https://openalex.org/W3164536451","https://openalex.org/W2809098816","https://openalex.org/W1586335975","https://openalex.org/W2467346053","https://openalex.org/W2601717023","https://openalex.org/W1537387353"],"abstract_inverted_index":{"In":[0],"the":[1,25,32,43,76,96,106,109],"recent":[2],"decades,":[3],"with":[4],"rapid":[5],"development":[6],"in":[7,20,46,78,114],"computing":[8],"power":[9],"and":[10,31,58,75,104],"algorithms,":[11],"machine":[12],"learning":[13],"(ML)":[14],"has":[15],"exhibited":[16],"its":[17],"enormous":[18],"potential":[19],"new":[21,59],"polymer":[22,38,60,71],"discovery.":[23],"Herein,":[24],"history":[26],"of":[27,35,65],"ML":[28,36,56,69],"is":[29,40,73,84],"described":[30],"basic":[33],"process":[34,48],"accelerated":[37,70],"discovery":[39,72],"summarized.":[41],"Next,":[42],"four":[44],"steps":[45],"this":[47,79,87,102,115],"are":[49,81,112],"reviewed,":[50],"that":[51,86],"is,":[52],"dataset":[53],"selection,":[54],"fingerprinting,":[55],"framework,":[57],"generation.":[61],"Finally,":[62],"a":[63,92],"couple":[64],"main":[66],"challenges":[67],"for":[68,95,108],"presented":[74],"outlooks":[77],"field":[80,103],"prospected.":[82],"It":[83],"expected":[85],"review":[88],"can":[89],"service":[90],"as":[91],"useful":[93],"tool":[94],"people":[97,110],"who":[98,111],"just":[99],"step":[100],"into":[101],"deepen":[105],"understanding":[107],"already":[113],"field.":[116]},"counts_by_year":[{"year":2026,"cited_by_count":20},{"year":2025,"cited_by_count":32},{"year":2024,"cited_by_count":22},{"year":2023,"cited_by_count":12}],"updated_date":"2026-07-15T18:14:33.161393","created_date":"2025-10-10T00:00:00"}