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TITLE: A big data approach to the ultra-fast prediction of DFT-calculated bond energies  Full Text
AUTHORS: Xiaohui H Qu; Diogo A R S Latino ; Joao Aires de Sousa ;
PUBLISHED: 2013, SOURCE: JOURNAL OF CHEMINFORMATICS, VOLUME: 5, ISSUE: 7
INDEXED IN: Scopus WOS CrossRef
IN MY: ORCID
5
TITLE: Automatic Perception of Chemical Similarities Between Metabolic Pathways  Full Text
AUTHORS: Diogo A R S Latino ; Joao Aires de Sousa ;
PUBLISHED: 2012, SOURCE: MOLECULAR INFORMATICS, VOLUME: 31, ISSUE: 2
INDEXED IN: Scopus WOS CrossRef
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TITLE: Models for Identification of Erroneous Atom-to-Atom Mapping of Reactions Performed by Automated Algorithms  Full Text
AUTHORS: Christophe Muller; Gilles Marcou; Dragos Horvath; Joao Aires de Sousa ; Alexandre Varnek;
PUBLISHED: 2012, SOURCE: JOURNAL OF CHEMICAL INFORMATION AND MODELING, VOLUME: 52, ISSUE: 12
INDEXED IN: Scopus WOS CrossRef
7
TITLE: Multivariate statistical approaches for wine classification based on low molecular weight phenolic compounds
AUTHORS: Cabrita, MJ ; Aires De Sousa, J ; Gomes Da Silva, MDRG ; Rei, F; Costa Freitas, AMC;
PUBLISHED: 2012, SOURCE: AUSTRALIAN JOURNAL OF GRAPE AND WINE RESEARCH, VOLUME: 18, ISSUE: 2
INDEXED IN: Scopus WOS
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TITLE: Classification of chemical reactions and chemoinformatic processing of enzymatic transformations.
AUTHORS: Latino, DA ; Aires de Sousa, J ;
PUBLISHED: 2011, SOURCE: Methods in molecular biology (Clifton, N.J.), VOLUME: 672
INDEXED IN: Scopus
IN MY: ORCID
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TITLE: MOLinsight: A Web Portal for the Processing of Molecular Structures by Blind Students  Full Text
AUTHORS: Florbela Pereira; Joao Aires de Sousa ; Vasco D B Bonifacio ; Paulina Mata; Ana M Lobo ;
PUBLISHED: 2011, SOURCE: JOURNAL OF CHEMICAL EDUCATION, VOLUME: 88, ISSUE: 3
INDEXED IN: Scopus WOS CrossRef
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