11
TITLE: Machine Learning Methods to Predict Density Functional Theory B3LYP Energies of HOMO and LUMO Orbitals  Full Text
AUTHORS: Florbela Pereira; Kaixia X Xiao; Diogo A R S Latino; Chengcheng C Wu; Qingyou Y Zhang; Joao Aires de Sousa;
PUBLISHED: 2017, SOURCE: JOURNAL OF CHEMICAL INFORMATION AND MODELING, VOLUME: 57, ISSUE: 1
INDEXED IN: WOS
12
TITLE: Machine Learning Estimation of Atom Condensed Fukui Functions  Full Text
AUTHORS: Qingyou Y Zhang; Fangfang F Zheng; Tanfeng F Zhao; Xiaohui H Qu; Joao Aires de Sousa;
PUBLISHED: 2016, SOURCE: MOLECULAR INFORMATICS, VOLUME: 35, ISSUE: 2
INDEXED IN: Scopus WOS CrossRef
14
TITLE: A QSPR approach for the fast estimation of DFT/NBO partial atomic charges  Full Text
AUTHORS: Qingyou Y Zhang; Fangfang F Zheng; Rui Fartaria; Diogo A R S Latino; Xiaohui H Qu; Tiago Campos; Tanfeng F Zhao; Joao Aires de Sousa;
PUBLISHED: 2014, SOURCE: 8th Colloquium on Chemiometricum Mediterraneum (CCM) in CHEMOMETRICS AND INTELLIGENT LABORATORY SYSTEMS, VOLUME: 134
INDEXED IN: Scopus WOS CrossRef
IN MY: ORCID
15
TITLE: Polymeric membranes for membrane reactors
AUTHORS: Vital, J; Sousa, JM;
PUBLISHED: 2013, SOURCE: Handbook of Membrane Reactors, VOLUME: 1
INDEXED IN: Scopus CrossRef
16
TITLE: Multivariate statistical approaches for wine classification based on low molecular weight phenolic compounds. Statistical approaches for wine classification  Full Text
AUTHORS: M.J CABRITA; AIRES-DE-SOUSA, J; M.D.R GOMES DA SILVA; REI, F; A.M COSTA FREITAS;
PUBLISHED: 2012, SOURCE: Australian Journal of Grape and Wine Research, VOLUME: 18, ISSUE: 2
INDEXED IN: CrossRef
IN MY: ORCID
17
TITLE: Hosts and Distribution of the Spider Mite Tetranychus evansi (Acari: Tetranychidae) in Portugal
AUTHORS: Ferreira, MA; Sousa, ME;
PUBLISHED: 2011, SOURCE: 28th International Horticultural Congress on Science and Horticulture for People/International Symposium on Plant Protection in XXVIII INTERNATIONAL HORTICULTURAL CONGRESS ON SCIENCE AND HORTICULTURE FOR PEOPLE (IHC2010): INTERNATIONAL SYMPOSIUM ON PLANT PROTECTION, VOLUME: 917, ISSUE: 917
INDEXED IN: Scopus WOS
19
TITLE: Combining Kohonen neural networks and variable selection by classification trees to cluster road soil samples  Full Text
AUTHORS: M.P Gómez-Carracedo; J.M Andrade; G.V.S.M Carrera; Aires-de-Sousa, J; Carlosena, A; Prada, D;
PUBLISHED: 2010, SOURCE: Chemometrics and Intelligent Laboratory Systems, VOLUME: 102, ISSUE: 1
INDEXED IN: CrossRef
IN MY: ORCID
20
TITLE: Prediction of mutagenicity based on empirical physicochemical descriptors  Full Text
AUTHORS: João Aires-de-Sousa;
PUBLISHED: 2009, SOURCE: Toxicology Letters, VOLUME: 189
INDEXED IN: CrossRef
IN MY: ORCID
Page 2 of 3. Total results: 30.