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Page 1
ELIXIR and Toxicology: a community in development.
Martens M, Stierum R, Schymanski EL, Evelo CT, Aalizadeh R, Aladjov H, Arturi K, Audouze K, Babica P, Berka K, Bessems J, Blaha L, Bolton EE, Cases M, Damalas DΕ, Dave K, Dilger M, Exner T, Geerke DP, Grafström R, Gray A, Hancock JM, Hollert H, Jeliazkova N, Jennen D, Jourdan F, Kahlem P, Klanova J, Kleinjans J, Kondic T, Kone B, Lynch I, Maran U, Martinez Cuesta S, Ménager H, Neumann S, Nymark P, Oberacher H, Ramirez N, Remy S, Rocca-Serra P, Salek RM, Sallach B, Sansone SA, Sanz F, Sarimveis H, Sarntivijai S, Schulze T, Slobodnik J, Spjuth O, Tedds J, Thomaidis N, Weber RJM, van Westen GJP, Wheelock CE, Williams AJ, Witters H, Zdrazil B, Županič A, Willighagen EL. Martens M, et al. Among authors: willighagen el. F1000Res. 2023 Oct 3;10:ELIXIR-1129. doi: 10.12688/f1000research.74502.2. eCollection 2021. F1000Res. 2023. PMID: 37842337 Free PMC article.
OSCAR4: a flexible architecture for chemical text-mining.
Jessop DM, Adams SE, Willighagen EL, Hawizy L, Murray-Rust P. Jessop DM, et al. Among authors: willighagen el. J Cheminform. 2011 Oct 14;3(1):41. doi: 10.1186/1758-2946-3-41. J Cheminform. 2011. PMID: 21999457 Free PMC article.
The Blue Obelisk-interoperability in chemical informatics.
Guha R, Howard MT, Hutchison GR, Murray-Rust P, Rzepa H, Steinbeck C, Wegner J, Willighagen EL. Guha R, et al. Among authors: willighagen el. J Chem Inf Model. 2006 May-Jun;46(3):991-8. doi: 10.1021/ci050400b. J Chem Inf Model. 2006. PMID: 16711717 Free PMC article.
Userscripts for the life sciences.
Willighagen EL, O'Boyle NM, Gopalakrishnan H, Jiao D, Guha R, Steinbeck C, Wild DJ. Willighagen EL, et al. BMC Bioinformatics. 2007 Dec 21;8:487. doi: 10.1186/1471-2105-8-487. BMC Bioinformatics. 2007. PMID: 18154664 Free PMC article.
Changing computational research. The challenges ahead.
Neylon C, Aerts J, Brown CT, Coles SJ, Hatton L, Lemire D, Millman KJ, Murray-Rust P, Perez F, Saunders N, Shah N, Smith A, Varoquaux G, Willighagen E. Neylon C, et al. Source Code Biol Med. 2012 May 28;7(1):2. doi: 10.1186/1751-0473-7-2. Source Code Biol Med. 2012. PMID: 22640749 Free PMC article. No abstract available.
Method for the computational comparison of crystal structures.
Willighagen EL, Wehrens R, Verwer P, de Gelder R, Buydens LM. Willighagen EL, et al. Acta Crystallogr B. 2005 Feb;61(Pt 1):29-36. doi: 10.1107/S0108768104028344. Epub 2005 Jan 19. Acta Crystallogr B. 2005. PMID: 15659855 Free article.
103 results