{"id":"https://openalex.org/W7223389082","doi":"https://doi.org/10.48550/arxiv.2610.30842","title":"A neural-network model to find correlations in astrochemical space","display_name":"A neural-network model to find correlations in astrochemical space","publication_year":2026,"publication_date":"2026-10-22","ids":{"openalex":"https://openalex.org/W7223389082","doi":"https://doi.org/10.48550/arxiv.2610.30842"},"language":"en","primary_location":{"id":"pmh:oai:arXiv.org:2610.30842","doi":null,"is_oa":true,"landing_page_url":"https://arxiv.org/abs/2610.30842","pdf_url":"https://arxiv.org/pdf/2610.30842","source":{"id":"https://openalex.org/S4306400194","display_name":"arXiv (Cornell University)","issn_l":"2331-8422","issn":["2331-8422"],"is_oa":true,"is_in_doaj":false,"is_core":false,"listed_in":[],"host_organization":"https://openalex.org/I205783295","host_organization_name":"Cornell University","host_organization_lineage":["https://openalex.org/I205783295"],"host_organization_lineage_names":[],"type":"repository"},"license":null,"license_id":null,"version":"submittedVersion","is_accepted":false,"is_published":false,"raw_source_name":null,"raw_type":"text"},"volume":null,"type":"preprint","is_traditional":true,"indexed_in":["arxiv","datacite"],"open_access":{"is_oa":true,"oa_status":"green","oa_url":"https://arxiv.org/pdf/2610.30842","any_repository_has_fulltext":true},"authorships":[{"author_position":"first","author":{"id":"https://openalex.org/A5159342661","display_name":"Daniel Giovanni Vargas","orcid":null,"observed_orcids":[]},"institutions":[{"id":"https://openalex.org/I36243813","display_name":"Universidad Nacional de Colombia","ror":"https://ror.org/059yx9a68","country_code":"CO","type":"education","lineage":["https://openalex.org/I36243813"]}],"countries":["CO"],"is_corresponding":false,"raw_author_name":"Vargas, Daniel Giovanni","raw_affiliation_strings":["Universidad Nacional de Colombia , Sede Bogot\u00e1 , Facultad de Ciencias ,"],"raw_orcid":null,"affiliations":[{"raw_affiliation_string":"Universidad Nacional de Colombia , Sede Bogot\u00e1 , Facultad de Ciencias ,","institution_ids":["https://openalex.org/I36243813"]}]},{"author_position":"middle","author":{"id":"https://openalex.org/A5067865909","display_name":"Dar\u00edo Barreiro\u2010Lage","orcid":"https://orcid.org/0000-0002-7022-3643","observed_orcids":["https://orcid.org/0000-0002-7022-3643"]},"institutions":[{"id":"https://openalex.org/I134820265","display_name":"Consejo Superior de Investigaciones Cient\u00edficas","ror":"https://ror.org/02gfc7t72","country_code":"ES","type":"government","lineage":["https://openalex.org/I134820265"]},{"id":"https://openalex.org/I4210095385","display_name":"Instituto de F\u00edsica Fundamental","ror":"https://ror.org/009wseg80","country_code":"ES","type":"facility","lineage":["https://openalex.org/I134820265","https://openalex.org/I4210095385"]}],"countries":["ES"],"is_corresponding":false,"raw_author_name":"Barreiro-Lage, Dar\u00edo","raw_affiliation_strings":["Departamento de Astrof\u00edsica Molecular , Instituto de F\u00edsica Fundamental (IFF-CSIC) , C/ Serrano 121 , 28006 Madrid , Spain"],"raw_orcid":null,"affiliations":[{"raw_affiliation_string":"Departamento de Astrof\u00edsica Molecular , Instituto de F\u00edsica Fundamental (IFF-CSIC) , C/ Serrano 121 , 28006 Madrid , Spain","institution_ids":["https://openalex.org/I134820265","https://openalex.org/I4210095385"]}]},{"author_position":"middle","author":{"id":"https://openalex.org/A5159671556","display_name":"Marcelino Ag\u00fandez","orcid":null,"observed_orcids":[]},"institutions":[{"id":"https://openalex.org/I134820265","display_name":"Consejo Superior de Investigaciones Cient\u00edficas","ror":"https://ror.org/02gfc7t72","country_code":"ES","type":"government","lineage":["https://openalex.org/I134820265"]},{"id":"https://openalex.org/I4210095385","display_name":"Instituto de F\u00edsica Fundamental","ror":"https://ror.org/009wseg80","country_code":"ES","type":"facility","lineage":["https://openalex.org/I134820265","https://openalex.org/I4210095385"]}],"countries":["ES"],"is_corresponding":false,"raw_author_name":"Ag\u00fandez, Marcelino","raw_affiliation_strings":["Departamento de Astrof\u00edsica Molecular , Instituto de F\u00edsica Fundamental (IFF-CSIC) , C/ Serrano 121 , 28006 Madrid , Spain"],"raw_orcid":null,"affiliations":[{"raw_affiliation_string":"Departamento de Astrof\u00edsica Molecular , Instituto de F\u00edsica Fundamental (IFF-CSIC) , C/ Serrano 121 , 28006 Madrid , Spain","institution_ids":["https://openalex.org/I134820265","https://openalex.org/I4210095385"]}]},{"author_position":"middle","author":{"id":"https://openalex.org/A5159577859","display_name":"Carlos Cabezas","orcid":null,"observed_orcids":[]},"institutions":[{"id":"https://openalex.org/I134820265","display_name":"Consejo Superior de Investigaciones Cient\u00edficas","ror":"https://ror.org/02gfc7t72","country_code":"ES","type":"government","lineage":["https://openalex.org/I134820265"]},{"id":"https://openalex.org/I36243813","display_name":"Universidad Nacional de Colombia","ror":"https://ror.org/059yx9a68","country_code":"CO","type":"education","lineage":["https://openalex.org/I36243813"]},{"id":"https://openalex.org/I4210095385","display_name":"Instituto de F\u00edsica Fundamental","ror":"https://ror.org/009wseg80","country_code":"ES","type":"facility","lineage":["https://openalex.org/I134820265","https://openalex.org/I4210095385"]}],"countries":["CO","ES"],"is_corresponding":false,"raw_author_name":"Cabezas, Carlos","raw_affiliation_strings":["Departamento de Astrof\u00edsica Molecular , Instituto de F\u00edsica Fundamental (IFF-CSIC) , C/ Serrano 121 , 28006 Madrid , Spain","Observatorio Astron\u00f3mico Nacional , Ciudad Universitaria , Bogot\u00e1 , Colombia"],"raw_orcid":null,"affiliations":[{"raw_affiliation_string":"Departamento de Astrof\u00edsica Molecular , Instituto de F\u00edsica Fundamental (IFF-CSIC) , C/ Serrano 121 , 28006 Madrid , Spain","institution_ids":["https://openalex.org/I134820265","https://openalex.org/I4210095385"]},{"raw_affiliation_string":"Observatorio Astron\u00f3mico Nacional , Ciudad Universitaria , Bogot\u00e1 , Colombia","institution_ids":["https://openalex.org/I36243813"]}]},{"author_position":"middle","author":{"id":"https://openalex.org/A5152798012","display_name":"Jose Cernicharo","orcid":null,"observed_orcids":[]},"institutions":[{"id":"https://openalex.org/I134820265","display_name":"Consejo Superior de Investigaciones Cient\u00edficas","ror":"https://ror.org/02gfc7t72","country_code":"ES","type":"government","lineage":["https://openalex.org/I134820265"]},{"id":"https://openalex.org/I4210095385","display_name":"Instituto de F\u00edsica Fundamental","ror":"https://ror.org/009wseg80","country_code":"ES","type":"facility","lineage":["https://openalex.org/I134820265","https://openalex.org/I4210095385"]}],"countries":["ES"],"is_corresponding":false,"raw_author_name":"Cernicharo, Jos\u00e9","raw_affiliation_strings":["Departamento de Astrof\u00edsica Molecular , Instituto de F\u00edsica Fundamental (IFF-CSIC) , C/ Serrano 121 , 28006 Madrid , Spain"],"raw_orcid":null,"affiliations":[{"raw_affiliation_string":"Departamento de Astrof\u00edsica Molecular , Instituto de F\u00edsica Fundamental (IFF-CSIC) , C/ Serrano 121 , 28006 Madrid , Spain","institution_ids":["https://openalex.org/I134820265","https://openalex.org/I4210095385"]}]},{"author_position":"last","author":{"id":"https://openalex.org/A5159342236","display_name":"Germ\u00e1n Molpeceres","orcid":null,"observed_orcids":[]},"institutions":[{"id":"https://openalex.org/I134820265","display_name":"Consejo Superior de Investigaciones Cient\u00edficas","ror":"https://ror.org/02gfc7t72","country_code":"ES","type":"government","lineage":["https://openalex.org/I134820265"]},{"id":"https://openalex.org/I4210095385","display_name":"Instituto de F\u00edsica Fundamental","ror":"https://ror.org/009wseg80","country_code":"ES","type":"facility","lineage":["https://openalex.org/I134820265","https://openalex.org/I4210095385"]}],"countries":["ES"],"is_corresponding":false,"raw_author_name":"Molpeceres, Germ\u00e1n","raw_affiliation_strings":["Departamento de Astrof\u00edsica Molecular , Instituto de F\u00edsica Fundamental (IFF-CSIC) , C/ Serrano 121 , 28006 Madrid , Spain"],"raw_orcid":null,"affiliations":[{"raw_affiliation_string":"Departamento de Astrof\u00edsica Molecular , Instituto de F\u00edsica Fundamental (IFF-CSIC) , C/ Serrano 121 , 28006 Madrid , Spain","institution_ids":["https://openalex.org/I134820265","https://openalex.org/I4210095385"]}]}],"institutions":[],"countries_distinct_count":2,"institutions_distinct_count":3,"corresponding_author_ids":[],"corresponding_institution_ids":[],"apc_list":null,"apc_paid":null,"fwci":null,"has_fulltext":true,"cited_by_count":0,"citation_normalized_percentile":null,"cited_by_percentile_year":null,"biblio":{"volume":null,"issue":null,"first_page":null,"last_page":null},"is_retracted":false,"is_paratext":false,"is_xpac":false,"primary_topic":{"id":"https://openalex.org/T10477","display_name":"Astrophysics and Star Formation Studies","score":0.9937000274658203,"subfield":{"id":"https://openalex.org/subfields/3103","display_name":"Astronomy and Astrophysics"},"field":{"id":"https://openalex.org/fields/31","display_name":"Physics and Astronomy"},"domain":{"id":"https://openalex.org/domains/3","display_name":"Physical Sciences"}},"topics":[{"id":"https://openalex.org/T10477","display_name":"Astrophysics and Star Formation Studies","score":0.9937000274658203,"subfield":{"id":"https://openalex.org/subfields/3103","display_name":"Astronomy and Astrophysics"},"field":{"id":"https://openalex.org/fields/31","display_name":"Physics and Astronomy"},"domain":{"id":"https://openalex.org/domains/3","display_name":"Physical Sciences"}},{"id":"https://openalex.org/T11948","display_name":"Machine Learning in Materials Science","score":0.0017999999690800905,"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/T10002","display_name":"Advanced Chemical Physics Studies","score":0.000699999975040555,"subfield":{"id":"https://openalex.org/subfields/3107","display_name":"Atomic and Molecular Physics, and Optics"},"field":{"id":"https://openalex.org/fields/31","display_name":"Physics and Astronomy"},"domain":{"id":"https://openalex.org/domains/3","display_name":"Physical Sciences"}}],"keywords":[{"id":"https://openalex.org/keywords/astrochemistry","display_name":"astrochemistry","score":0.7879999876022339},{"id":"https://openalex.org/keywords/interstellar-molecules","display_name":"interstellar molecules","score":0.9049999713897705},{"id":"https://openalex.org/keywords/tmc-1","display_name":"TMC-1","score":0.9789999723434448},{"id":"https://openalex.org/keywords/molecular-structure-encoding","display_name":"molecular structure encoding","score":0.5210000276565552},{"id":"https://openalex.org/keywords/natural-language-processing","display_name":"natural language processing","score":0.5699999928474426},{"id":"https://openalex.org/keywords/neural-network","display_name":"artificial neural networks","score":0.5839999914169312},{"id":"https://openalex.org/keywords/latent-representations","display_name":"latent representations","score":0.5799999833106995},{"id":"https://openalex.org/keywords/interstellar-chemistry","display_name":"interstellar chemistry","score":0.5979999899864197}],"concepts":[{"id":"https://openalex.org/C121332964","wikidata":"https://www.wikidata.org/wiki/Q413","display_name":"Physics","level":0,"score":0.6238999962806702},{"id":"https://openalex.org/C132010649","wikidata":"https://www.wikidata.org/wiki/Q189222","display_name":"Intuition","level":2,"score":0.5370000004768372},{"id":"https://openalex.org/C121864883","wikidata":"https://www.wikidata.org/wiki/Q677916","display_name":"Statistical physics","level":1,"score":0.5105999708175659},{"id":"https://openalex.org/C98444146","wikidata":"https://www.wikidata.org/wiki/Q318","display_name":"Galaxy","level":2,"score":0.4375},{"id":"https://openalex.org/C2778572836","wikidata":"https://www.wikidata.org/wiki/Q380933","display_name":"Space (punctuation)","level":2,"score":0.41530001163482666},{"id":"https://openalex.org/C9652623","wikidata":"https://www.wikidata.org/wiki/Q190109","display_name":"Field (mathematics)","level":2,"score":0.41290000081062317},{"id":"https://openalex.org/C177212765","wikidata":"https://www.wikidata.org/wiki/Q627335","display_name":"Workflow","level":2,"score":0.39559999108314514},{"id":"https://openalex.org/C44870925","wikidata":"https://www.wikidata.org/wiki/Q37547","display_name":"Astrophysics","level":1,"score":0.37630000710487366},{"id":"https://openalex.org/C73586568","wikidata":"https://www.wikidata.org/wiki/Q2600211","display_name":"Parameter space","level":2,"score":0.35929998755455017},{"id":"https://openalex.org/C33332235","wikidata":"https://www.wikidata.org/wiki/Q18362","display_name":"Theoretical physics","level":1,"score":0.35580000281333923},{"id":"https://openalex.org/C2989277613","wikidata":"https://www.wikidata.org/wiki/Q283","display_name":"Liquid water","level":2,"score":0.35089999437332153},{"id":"https://openalex.org/C99726746","wikidata":"https://www.wikidata.org/wiki/Q906396","display_name":"Chemical space","level":3,"score":0.3050000071525574},{"id":"https://openalex.org/C41008148","wikidata":"https://www.wikidata.org/wiki/Q21198","display_name":"Computer science","level":0,"score":0.2922999858856201},{"id":"https://openalex.org/C170797541","wikidata":"https://www.wikidata.org/wiki/Q452399","display_name":"Error bar","level":2,"score":0.2757999897003174},{"id":"https://openalex.org/C196939603","wikidata":"https://www.wikidata.org/wiki/Q41872","display_name":"Interstellar medium","level":3,"score":0.27090001106262207},{"id":"https://openalex.org/C76969082","wikidata":"https://www.wikidata.org/wiki/Q486902","display_name":"Mathematical model","level":2,"score":0.26440000534057617},{"id":"https://openalex.org/C83546350","wikidata":"https://www.wikidata.org/wiki/Q1139051","display_name":"Regression","level":2,"score":0.2632000148296356}],"mesh":[],"locations_count":2,"locations":[{"id":"pmh:oai:arXiv.org:2610.30842","doi":null,"is_oa":true,"landing_page_url":"https://arxiv.org/abs/2610.30842","pdf_url":"https://arxiv.org/pdf/2610.30842","source":{"id":"https://openalex.org/S4306400194","display_name":"arXiv (Cornell University)","issn_l":"2331-8422","issn":["2331-8422"],"is_oa":true,"is_in_doaj":false,"is_core":false,"listed_in":[],"host_organization":"https://openalex.org/I205783295","host_organization_name":"Cornell University","host_organization_lineage":["https://openalex.org/I205783295"],"host_organization_lineage_names":[],"type":"repository"},"license":null,"license_id":null,"version":"submittedVersion","is_accepted":false,"is_published":false,"raw_source_name":null,"raw_type":"text"},{"id":"doi:10.48550/arxiv.2610.30842","doi":"https://doi.org/10.48550/arxiv.2610.30842","is_oa":true,"landing_page_url":"https://doi.org/10.48550/arxiv.2610.30842","pdf_url":null,"source":{"id":"https://openalex.org/S4306400194","display_name":"arXiv (Cornell University)","issn_l":"2331-8422","issn":["2331-8422"],"is_oa":true,"is_in_doaj":false,"is_core":false,"listed_in":[],"host_organization":"https://openalex.org/I205783295","host_organization_name":"Cornell University","host_organization_lineage":["https://openalex.org/I205783295"],"host_organization_lineage_names":[],"type":"repository"},"license":null,"license_id":null,"version":null,"is_accepted":false,"is_published":false,"raw_source_name":null,"raw_type":"Preprint"}],"best_oa_location":{"id":"pmh:oai:arXiv.org:2610.30842","doi":null,"is_oa":true,"landing_page_url":"https://arxiv.org/abs/2610.30842","pdf_url":"https://arxiv.org/pdf/2610.30842","source":{"id":"https://openalex.org/S4306400194","display_name":"arXiv (Cornell University)","issn_l":"2331-8422","issn":["2331-8422"],"is_oa":true,"is_in_doaj":false,"is_core":false,"listed_in":[],"host_organization":"https://openalex.org/I205783295","host_organization_name":"Cornell University","host_organization_lineage":["https://openalex.org/I205783295"],"host_organization_lineage_names":[],"type":"repository"},"license":null,"license_id":null,"version":"submittedVersion","is_accepted":false,"is_published":false,"raw_source_name":null,"raw_type":"text"},"sustainable_development_goals":[],"study_designs":[],"awards":[{"id":"https://openalex.org/G1272900390","display_name":null,"funder_award_id":"PID2023","funder_id":"https://openalex.org/F4320315062","funder_display_name":"Ministerio de Ciencia, Innovaci\u00f3n y Universidades"},{"id":"https://openalex.org/G1274526653","display_name":null,"funder_award_id":"PID2023-147545NB-I00","funder_id":"https://openalex.org/F4320315062","funder_display_name":"Ministerio de Ciencia, Innovaci\u00f3n y Universidades"},{"id":"https://openalex.org/G1390270801","display_name":null,"funder_award_id":"101218790","funder_id":"https://openalex.org/F4320320300","funder_display_name":"European Commission"},{"id":"https://openalex.org/G3443738222","display_name":null,"funder_award_id":"PID2023-147545NB-I00","funder_id":"https://openalex.org/F4320335598","funder_display_name":"Agencia Estatal de Investigaci\u00f3n"},{"id":"https://openalex.org/G4306083348","display_name":null,"funder_award_id":"PID2024-156686NB-I00","funder_id":"https://openalex.org/F4320315062","funder_display_name":"Ministerio de Ciencia, Innovaci\u00f3n y Universidades"},{"id":"https://openalex.org/G5184147302","display_name":null,"funder_award_id":"RYC2022-035442-I","funder_id":"https://openalex.org/F4320338080","funder_display_name":"European Social Fund"},{"id":"https://openalex.org/G5572486069","display_name":null,"funder_award_id":"PID2023-147545NB-I00","funder_id":"https://openalex.org/F4320320300","funder_display_name":"European Commission"},{"id":"https://openalex.org/G5635532810","display_name":null,"funder_award_id":"13039","funder_id":"https://openalex.org/F4320315062","funder_display_name":"Ministerio de Ciencia, Innovaci\u00f3n y Universidades"},{"id":"https://openalex.org/G7057395327","display_name":null,"funder_award_id":"PID2024-156686NB-I00","funder_id":"https://openalex.org/F4320335598","funder_display_name":"Agencia Estatal de Investigaci\u00f3n"},{"id":"https://openalex.org/G717256432","display_name":null,"funder_award_id":"PID2024","funder_id":"https://openalex.org/F4320315062","funder_display_name":"Ministerio de Ciencia, Innovaci\u00f3n y Universidades"},{"id":"https://openalex.org/G7312425167","display_name":null,"funder_award_id":"RYC2022-035442-I","funder_id":"https://openalex.org/F4320335598","funder_display_name":"Agencia Estatal de Investigaci\u00f3n"},{"id":"https://openalex.org/G7395345766","display_name":null,"funder_award_id":"MICIU/AEI/10.13039","funder_id":"https://openalex.org/F4320315062","funder_display_name":"Ministerio de Ciencia, Innovaci\u00f3n y Universidades"},{"id":"https://openalex.org/G7805626310","display_name":null,"funder_award_id":"10.13039","funder_id":"https://openalex.org/F4320315062","funder_display_name":"Ministerio de Ciencia, Innovaci\u00f3n y Universidades"},{"id":"https://openalex.org/G7835171633","display_name":null,"funder_award_id":"RYC2022-035442-I","funder_id":"https://openalex.org/F4320315062","funder_display_name":"Ministerio de Ciencia, Innovaci\u00f3n y Universidades"},{"id":"https://openalex.org/G8667377315","display_name":null,"funder_award_id":"MICIU/AEI/10","funder_id":"https://openalex.org/F4320315062","funder_display_name":"Ministerio de Ciencia, Innovaci\u00f3n y Universidades"},{"id":"https://openalex.org/G8855400342","display_name":null,"funder_award_id":"RYC2022-035442-I","funder_id":"https://openalex.org/F4320320300","funder_display_name":"European Commission"}],"funders":[{"id":"https://openalex.org/F4320315062","display_name":"Ministerio de Ciencia, Innovaci\u00f3n y Universidades","ror":null},{"id":"https://openalex.org/F4320320300","display_name":"European Commission","ror":"https://ror.org/00k4n6c32"},{"id":"https://openalex.org/F4320335598","display_name":"Agencia Estatal de Investigaci\u00f3n","ror":"https://ror.org/003x0zc53"},{"id":"https://openalex.org/F4320338080","display_name":"European Social Fund","ror":"https://ror.org/00k4n6c32"}],"has_content":{"grobid_xml":true,"pdf":true},"content_urls":{"pdf":"https://content.openalex.org/works/W7223389082.pdf","grobid_xml":"https://content.openalex.org/works/W7223389082.grobid-xml"},"referenced_works_count":11,"referenced_works":["https://openalex.org/W2782794990","https://openalex.org/W2893863737","https://openalex.org/W2940523525","https://openalex.org/W2965373594","https://openalex.org/W3046249469","https://openalex.org/W3082438234","https://openalex.org/W3091535276","https://openalex.org/W3093934881","https://openalex.org/W3157774113","https://openalex.org/W3165757723","https://openalex.org/W3205390097"],"related_works":["https://openalex.org/W3202797015","https://openalex.org/W4410478715","https://openalex.org/W3194266919","https://openalex.org/W4415494313","https://openalex.org/W7009715179","https://openalex.org/W4396689956","https://openalex.org/W6887926028","https://openalex.org/W3093368526","https://openalex.org/W4407799706","https://openalex.org/W7128209403"],"abstract_inverted_index":{"The":[0,66,102,131],"detection":[1,177],"of":[2,31,110,117,121,123,154,166,186,199,215,228,252],"new":[3,250],"interstellar":[4,152,216],"molecules":[5,161],"is":[6],"central":[7],"to":[8,45,52,89],"astrochemistry,":[9],"and":[10,29,60,99,112,119,128,148,234,256],"arguably":[11],"the":[12,17,24,50,95,126,136,144,150,155,167,191,237,242],"most":[13],"transformative":[14],"development":[15],"in":[16,19,26,49,64,76,160,178,202,218],"field":[18],"past":[20],"decade":[21],"has":[22],"been":[23],"increase":[25],"both":[27,94,232],"number":[28,185],"diversity":[30],"detected":[32],"species.":[33,101,188],"Using":[34,157],"natural":[35],"language":[36],"processing":[37],"models,":[38],"we":[39,170,204],"develop":[40],"a":[41,86,183,219,245],"machine-learning":[42],"pipeline,":[43],"similar":[44],"other":[46],"approaches":[47],"reported":[48],"literature,":[51],"connect":[53],"molecular":[54,61,97,200,208],"structures,":[55],"encoded":[56],"as":[57],"chemical":[58,146],"strings,":[59],"column":[62],"densities":[63],"TMC-1.":[65],"workflow":[67],"generates":[68],"astrochemically":[69],"informed":[70],"embeddings":[71],"that":[72,142,206],"can":[73],"be":[74],"employed":[75],"subsequent":[77],"supervised":[78],"learning":[79],"tasks.":[80],"These":[81],"representations":[82,239],"are":[83,138],"used":[84],"within":[85],"neural-network":[87],"framework":[88],"perform":[90],"column-density":[91,229],"regression":[92],"on":[93,193],"original":[96],"inventory":[98],"out-of-distribution":[100,235],"resulting":[103],"model":[104,137,192,243],"achieves":[105],"mean":[106,113],"squared":[107],"error":[108,115],"values":[109,116],"0.17/0.58":[111],"absolute":[114],"0.29/0.59,":[118],"coefficients":[120],"determination":[122],"0.88/0.51":[124],"for":[125,175,231,248],"train+validation":[127],"validation":[129],"datasets.":[130],"latent":[132],"vectors":[133,159],"learned":[134],"by":[135,241],"rich":[139],"mathematical":[140],"objects":[141],"capture":[143],"underlying":[145],"relations":[147],"also":[149],"potential":[151],"detectability":[153],"molecule.":[156],"these":[158],"obtained":[162],"from":[163],"systematic":[164],"permutations":[165],"TMC-1":[168],"inventory,":[169],"identify":[171],"several":[172],"promising":[173],"candidates":[174],"future":[176],"this":[179],"cloud,":[180],"together":[181],"with":[182],"large":[184],"apolar":[187],"By":[189],"training":[190],"datasets":[194],"reflecting":[195],"different":[196],"historical":[197],"epochs":[198],"detections":[201,209],"TMC-1,":[203],"show":[205],"recent":[207],"have":[210],"substantially":[211],"reshaped":[212],"our":[213],"understanding":[214],"chemistry,":[217],"transformative,":[220],"rather":[221],"than":[222],"incremental,":[223],"way.":[224],"Beyond":[225],"accurate":[226],"prediction":[227],"trends":[230],"in-distribution":[233],"molecules,":[236],"latent-space":[238],"produced":[240],"provide":[244],"stepping":[246],"stone":[247],"developing":[249],"forms":[251],"data-driven":[253],"astrochemical":[254],"intuition":[255],"exploration.":[257]},"counts_by_year":[],"updated_date":"2026-11-07T11:25:07.637180","created_date":"2026-10-24T00:00:00"}
