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Graph neural networks: A review of methods and applicationsZhou, Jie ; Cui, Ganqu ; Hu, Shengding ; Zhang, Zhengyan ; Yang, Cheng ; Liu, Zhiyuan ; Wang, Lifeng ; Li, Changcheng ; Sun, MaosongAI open, 2020, Vol.1, p.57-81 [Periódico revisado por pares]Elsevier B.VTexto completo disponível |
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PROSPER (Project, Sustainability, and Perseverance) Learning Model in English for Computer ScienceWahyuni, Dewi Sari ; Rozimela, Yenni ; Ardi, Havid ; Mukhaiyar, Mukhaiyar ; Darmansyah, DarmansyahSustainability, 2022-12, Vol.14 (24), p.16749 [Periódico revisado por pares]Basel: MDPI AGTexto completo disponível |
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Probabilistic programming in Python using PyMC3Salvatier, John ; Wiecki, Thomas V. ; Fonnesbeck, ChristopherPeerJ. Computer science, 2016-04, Vol.2, p.e55, Article e55 [Periódico revisado por pares]San Diego: PeerJ, IncTexto completo disponível |
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RIdeogram : drawing SVG graphics to visualize and map genome-wide data on the idiogramsHao, Zhaodong ; Lv, Dekang ; Ge, Ying ; Shi, Jisen ; Weijers, Dolf ; Yu, Guangchuang ; Chen, JinhuiPeerJ. Computer science, 2020-01, Vol.6, p.e251-e251, Article e251 [Periódico revisado por pares]United States: PeerJ. LtdTexto completo disponível |
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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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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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Towards better analysis of machine learning models: A visual analytics perspectiveLiu, Shixia ; Wang, Xiting ; Liu, Mengchen ; Zhu, JunVisual informatics (Online), 2017-03, Vol.1 (1), p.48-56 [Periódico revisado por pares]Elsevier B.VTexto completo disponível |
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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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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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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 |