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Accelerating fibre orientation estimation from diffusion weighted magnetic resonance imaging using GPUsHernández, Moisés ; Guerrero, Ginés D ; Cecilia, José M ; García, José M ; Inuggi, Alberto ; Jbabdi, Saad ; Behrens, Timothy E J ; Sotiropoulos, Stamatios N Yacoub, EssaPloS one, 2013-04, Vol.8 (4), p.e61892-e61892 [Periódico revisado por pares]United States: Public Library of ScienceTexto completo disponível |
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ADMETlab: a platform for systematic ADMET evaluation based on a comprehensively collected ADMET databaseDong, Jie ; Wang, Ning-Ning ; Yao, Zhi-Jiang ; Zhang, Lin ; Cheng, Yan ; Ouyang, Defang ; Lu, Ai-Ping ; Cao, Dong-ShengJournal of cheminformatics, 2018-06, Vol.10 (1), p.29-11, Article 29 [Periódico revisado por pares]Cham: Springer International PublishingTexto completo disponível |
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Material Type: Artigo
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A Meta-Analysis of Use of Serious Games in Education over a DecadeZhonggen, Yu Katchabaw, Michael J. ; Michael J KatchabawInternational journal of computer games technology, 2019-01, Vol.2019, p.1-8 [Periódico revisado por pares]New York: HindawiTexto completo disponível |
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Material Type: Artigo
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BioTransformer: a comprehensive computational tool for small molecule metabolism prediction and metabolite identificationDjoumbou-Feunang, Yannick ; Fiamoncini, Jarlei ; Gil-de-la-Fuente, Alberto ; Greiner, Russell ; Manach, Claudine ; Wishart, David S.Journal of cheminformatics, 2019-01, Vol.11 (1), p.2-25, Article 2 [Periódico revisado por pares]Cham: Springer International PublishingTexto completo disponível |
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Material Type: Artigo
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Supercharge your data wrangling with a graphics cardMatthews, DavidNature (London), 2018-10, Vol.562 (7725), p.151-152 [Periódico revisado por pares]England: Nature Publishing GroupTexto completo disponível |
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Material Type: Artigo
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P2Rank: machine learning based tool for rapid and accurate prediction of ligand binding sites from protein structureKrivák, Radoslav ; Hoksza, DavidJournal of cheminformatics, 2018-08, Vol.10 (1), p.39-12, Article 39 [Periódico revisado por pares]Cham: Springer International PublishingTexto completo disponível |
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Material Type: Artigo
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AiZynthFinder: a fast, robust and flexible open-source software for retrosynthetic planningGenheden, Samuel ; Thakkar, Amol ; Chadimová, Veronika ; Reymond, Jean-Louis ; Engkvist, Ola ; Bjerrum, EsbenJournal of cheminformatics, 2020-11, Vol.12 (1), p.70-70, Article 70 [Periódico revisado por pares]Cham: Springer International PublishingTexto completo disponível |
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Material Type: Artigo
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Supercell program: a combinatorial structure-generation approach for the local-level modeling of atomic substitutions and partial occupancies in crystalsOkhotnikov, Kirill ; Charpentier, Thibault ; Cadars, SylvianJournal of cheminformatics, 2016-03, Vol.8 (1), p.17-17, Article 17 [Periódico revisado por pares]Cham: Springer International PublishingTexto completo disponível |
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Material Type: Artigo
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High-throughput sequence alignment using Graphics Processing UnitsSchatz, Michael C ; Trapnell, Cole ; Delcher, Arthur L ; Varshney, AmitabhBMC bioinformatics, 2007-12, Vol.8 (1), p.474-474, Article 474 [Periódico revisado por pares]England: BioMed Central LtdTexto completo disponível |
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Material Type: Artigo
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ChemDes: an integrated web-based platform for molecular descriptor and fingerprint computationDong, Jie ; Cao, Dong-Sheng ; Miao, Hong-Yu ; Liu, Shao ; Deng, Bai-Chuan ; Yun, Yong-Huan ; Wang, Ning-Ning ; Lu, Ai-Ping ; Zeng, Wen-Bin ; Chen, Alex F.Journal of cheminformatics, 2015-12, Vol.7 (1), Article 60 [Periódico revisado por pares]Cham: Springer International PublishingTexto completo disponível |