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2010 – 2019
- 2017
[j5]Florbela Pereira
, Kaixia Xiao, Diogo A. R. S. Latino, Chengcheng Wu, Qing-You Zhang, João Aires-de-Sousa:
Machine Learning Methods to Predict Density Functional Theory B3LYP Energies of HOMO and LUMO Orbitals. J. Chem. Inf. Model. 57(1): 11-21 (2017)- 2015
- [j4]Gilles Marcou, João Aires-de-Sousa, Diogo A. R. S. Latino, Aurélie de Luca, Dragos Horvath, V. Rietsch, Alexandre Varnek:
Expert System for Predicting Reaction Conditions: The Michael Reaction Case. J. Chem. Inf. Model. 55(2): 239-250 (2015) - 2013
- [j3]Xiaohui Qu, Diogo A. R. S. Latino, João Aires-de-Sousa:
A big data approach to the ultra-fast prediction of DFT-calculated bond energies. J. Cheminformatics 5: 34 (2013)
2000 – 2009
- 2009
- [j2]Diogo A. R. S. Latino, João Aires-de-Sousa:
Assignment of EC Numbers to Enzymatic Reactions with MOLMAP Reaction Descriptors and Random Forests. J. Chem. Inf. Model. 49(7): 1839-1846 (2009) - 2008
- [b1]Diogo A. R. S. Latino:
Automatic learning for the classification of chemical reactions and in statistical thermodynamics. NOVA University Lisbon, Portugal, 2008 - [j1]Diogo A. R. S. Latino, Qing-You Zhang, João Aires-de-Sousa:
Genome-scale classification of metabolic reactions and assignment of EC numbers with self-organizing maps. Bioinform. 24(19): 2236-2244 (2008)
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