{"status":"ok","message-type":"work","message-version":"1.0.0","message":{"indexed":{"date-parts":[[2025,2,21]],"date-time":"2025-02-21T16:32:38Z","timestamp":1740155558529,"version":"3.37.3"},"reference-count":15,"publisher":"Springer Science and Business Media LLC","issue":"1","license":[{"start":{"date-parts":[[2024,1,15]],"date-time":"2024-01-15T00:00:00Z","timestamp":1705276800000},"content-version":"tdm","delay-in-days":0,"URL":"https:\/\/creativecommons.org\/licenses\/by\/4.0"},{"start":{"date-parts":[[2024,1,15]],"date-time":"2024-01-15T00:00:00Z","timestamp":1705276800000},"content-version":"vor","delay-in-days":0,"URL":"https:\/\/creativecommons.org\/licenses\/by\/4.0"}],"content-domain":{"domain":["link.springer.com"],"crossmark-restriction":false},"short-container-title":["J Cheminform"],"DOI":"10.1186\/s13321-023-00798-6","type":"journal-article","created":{"date-parts":[[2024,1,15]],"date-time":"2024-01-15T00:16:17Z","timestamp":1705277777000},"update-policy":"https:\/\/doi.org\/10.1007\/springer_crossmark_policy","source":"Crossref","is-referenced-by-count":0,"title":["Are new ideas harder to find? A note on incremental research and Journal of Cheminformatics\u2019 Scientific Contribution Statement"],"prefix":"10.1186","volume":"16","author":[{"ORCID":"https:\/\/orcid.org\/0000-0001-9395-1515","authenticated-orcid":false,"given":"Barbara","family":"Zdrazil","sequence":"first","affiliation":[],"role":[{"role":"author","vocabulary":"crossref"}]},{"ORCID":"https:\/\/orcid.org\/0000-0001-7403-8819","authenticated-orcid":false,"given":"Rajarshi","family":"Guha","sequence":"additional","affiliation":[],"role":[{"role":"author","vocabulary":"crossref"}]},{"ORCID":"https:\/\/orcid.org\/0000-0002-6974-7941","authenticated-orcid":false,"given":"Karina","family":"Martinez-Mayorga","sequence":"additional","affiliation":[],"role":[{"role":"author","vocabulary":"crossref"}]},{"given":"Nina","family":"Jeliazkova","sequence":"additional","affiliation":[],"role":[{"role":"author","vocabulary":"crossref"}]}],"member":"297","published-online":{"date-parts":[[2024,1,15]]},"reference":[{"key":"798_CR1","doi-asserted-by":"publisher","DOI":"10.1016\/j.sbi.2023.102527","volume":"79","author":"F Grisoni","year":"2023","unstructured":"Grisoni F (2023) Chemical language models for de novo drug design: challenges and opportunities. Curr Opin Struct Biol 79:102527. https:\/\/doi.org\/10.1016\/j.sbi.2023.102527","journal-title":"Curr Opin Struct Biol"},{"key":"798_CR2","unstructured":"Bhaskar M (2021) Human frontiers: the future of big ideas in an age of small thinking"},{"key":"798_CR3","doi-asserted-by":"publisher","first-page":"428","DOI":"10.1038\/nrd3405","volume":"10","author":"F Pammolli","year":"2011","unstructured":"Pammolli F, Magazzini L, Riccaboni M (2011) The productivity crisis in pharmaceutical R&D. Nat Rev Drug Discov 10:428\u2013438. https:\/\/doi.org\/10.1038\/nrd3405","journal-title":"Nat Rev Drug Discov"},{"key":"798_CR4","doi-asserted-by":"publisher","first-page":"164","DOI":"10.1007\/s43546-021-00163-5","volume":"1","author":"U Laermann-Nguyen","year":"2021","unstructured":"Laermann-Nguyen U, Backfisch M (2021) Innovation crisis in the pharmaceutical industry? A survey. SN Bus Econ 1:164. https:\/\/doi.org\/10.1007\/s43546-021-00163-5","journal-title":"SN Bus Econ"},{"key":"798_CR5","doi-asserted-by":"publisher","first-page":"1","DOI":"10.1086\/ipe.7.25056188","volume":"7","author":"IM Cockburn","year":"2006","unstructured":"Cockburn IM (2006) Is the pharmaceutical industry in a productivity crisis? Innov Policy Econ 7:1\u201332. https:\/\/doi.org\/10.1086\/ipe.7.25056188","journal-title":"Innov Policy Econ"},{"key":"798_CR6","first-page":"87","volume":"19","author":"S Rawat","year":"2014","unstructured":"Rawat S, Meena S (2014) Publish or perish: where are we heading? J Res Med Sci 19:87\u201389","journal-title":"J Res Med Sci"},{"key":"798_CR7","unstructured":"https:\/\/zenodo.org\/"},{"key":"798_CR8","unstructured":"https:\/\/github.com\/"},{"key":"798_CR9","unstructured":"https:\/\/huggingface.co\/"},{"key":"798_CR10","doi-asserted-by":"publisher","DOI":"10.1002\/wcms.1603","volume":"12","author":"DS Wigh","year":"2022","unstructured":"Wigh DS, Goodman JM, Lapkin AA (2022) A review of molecular representation in the age of machine learning. WIREs Comput Mol Sci 12:e1603. https:\/\/doi.org\/10.1002\/wcms.1603","journal-title":"WIREs Comput Mol Sci"},{"key":"798_CR11","doi-asserted-by":"publisher","first-page":"2196","DOI":"10.1007\/978-0-387-30440-3_136","volume-title":"Encyclopedia of complexity and Systems Science","author":"AT Balaban","year":"2009","unstructured":"Balaban AT (2009) Drug Design, Molecular descriptors in. In: Meyers RA (ed) Encyclopedia of complexity and Systems Science. Springer, New York, NY, pp 2196\u20132215"},{"key":"798_CR12","doi-asserted-by":"publisher","first-page":"181","DOI":"10.2174\/1573409912666160525112114","volume":"12","author":"S Sahoo","year":"2016","unstructured":"Sahoo S, Adhikari C, Kuanar M, Mishra BK (2016) A short review of the generation of Molecular descriptors and their applications in quantitative structure Property\/Activity relationships. Curr Comput Aided Drug Des 12:181\u2013205. https:\/\/doi.org\/10.2174\/1573409912666160525112114","journal-title":"Curr Comput Aided Drug Des"},{"key":"798_CR13","doi-asserted-by":"publisher","first-page":"4574","DOI":"10.3390\/ijms20184574","volume":"20","author":"PHM Torres","year":"2019","unstructured":"Torres PHM, Sodero ACR, Jofily P, Silva-Jr FP (2019) Key topics in molecular docking for drug design. Int J Mol Sci 20:4574. https:\/\/doi.org\/10.3390\/ijms20184574","journal-title":"Int J Mol Sci"},{"key":"798_CR14","doi-asserted-by":"publisher","DOI":"10.3390\/fi15080260","volume":"15","author":"A Bandi","year":"2023","unstructured":"Bandi A, Adapa PVSR, Kuchi YEVPK (2023) The Power of Generative AI: a review of requirements, models, input\u2013output formats, evaluation Metrics, and challenges. Future Internet 15:260. https:\/\/doi.org\/10.3390\/fi15080260","journal-title":"Future Internet"},{"key":"798_CR15","unstructured":"Shokrollahi Y, Yarmohammadtoosky S, Nikahd MM et al (2023) A comprehensive review of generative AI in healthcare"}],"container-title":["Journal of Cheminformatics"],"original-title":[],"language":"en","link":[{"URL":"https:\/\/link.springer.com\/content\/pdf\/10.1186\/s13321-023-00798-6.pdf","content-type":"application\/pdf","content-version":"vor","intended-application":"text-mining"},{"URL":"https:\/\/link.springer.com\/article\/10.1186\/s13321-023-00798-6\/fulltext.html","content-type":"text\/html","content-version":"vor","intended-application":"text-mining"},{"URL":"https:\/\/link.springer.com\/content\/pdf\/10.1186\/s13321-023-00798-6.pdf","content-type":"application\/pdf","content-version":"vor","intended-application":"similarity-checking"}],"deposited":{"date-parts":[[2024,1,15]],"date-time":"2024-01-15T00:16:45Z","timestamp":1705277805000},"score":1,"resource":{"primary":{"URL":"https:\/\/jcheminf.biomedcentral.com\/articles\/10.1186\/s13321-023-00798-6"}},"subtitle":[],"short-title":[],"issued":{"date-parts":[[2024,1,15]]},"references-count":15,"journal-issue":{"issue":"1","published-online":{"date-parts":[[2024,12]]}},"alternative-id":["798"],"URL":"https:\/\/doi.org\/10.1186\/s13321-023-00798-6","relation":{},"ISSN":["1758-2946"],"issn-type":[{"type":"electronic","value":"1758-2946"}],"subject":[],"published":{"date-parts":[[2024,1,15]]},"assertion":[{"value":"15 January 2024","order":1,"name":"first_online","label":"First Online","group":{"name":"ArticleHistory","label":"Article History"}},{"order":1,"name":"Ethics","group":{"name":"EthicsHeading","label":"Declarations"}},{"value":"The authors declare that they have no competing interests.","order":2,"name":"Ethics","group":{"name":"EthicsHeading","label":"Competing interests"}}],"article-number":"6"}}