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Chemometrics in analytical chemistry-part I: history, experimental design and data analysis tools.
Brereton, Richard G; Jansen, Jeroen; Lopes, João; Marini, Federico; Pomerantsev, Alexey; Rodionova, Oxana; Roger, Jean Michel; Walczak, Beata; Tauler, Romà.
Affiliation
  • Brereton RG; School of Chemistry, University of Bristol, Cantocks Close, Bristol, BS8 1TS, UK.
  • Jansen J; Institute for Molecules and Materials, Radboud University, Postvak 61, P.O. Box 9010, 6500 GL, Nijmegen, The Netherlands.
  • Lopes J; Research Institute for Medicines (iMed.ULisboa), Faculdade de Farmácia, Universidade de Lisboa, Av. Prof. Gama Pinto, 1649-003, Lisbon, Portugal.
  • Marini F; Department of Chemistry, University of Rome "La Sapienza", Piazzale Aldo Moro 5, 00185, Rome, Italy.
  • Pomerantsev A; Institute of Chemical Physics RAS, 4, Kosygin Str, 119991, Moscow, Russia.
  • Rodionova O; Institute of Chemical Physics RAS, 4, Kosygin Str, 119991, Moscow, Russia.
  • Roger JM; Irstea, UMR ITAP, 361 Rue Jean-François Breton, 34000, Montpellier, France.
  • Walczak B; Institute of Chemistry, University of Silesia , 40-006, Katowice, Poland.
  • Tauler R; IDAEA-CSIC, Jordi Girona 18-26, 08034, Barcelona, Spain. Roma.Tauler@idaea.csic.es.
Anal Bioanal Chem ; 409(25): 5891-5899, 2017 Oct.
Article in En | MEDLINE | ID: mdl-28776070
Chemometrics has achieved major recognition and progress in the analytical chemistry field. In the first part of this tutorial, major achievements and contributions of chemometrics to some of the more important stages of the analytical process, like experimental design, sampling, and data analysis (including data pretreatment and fusion), are summarised. The tutorial is intended to give a general updated overview of the chemometrics field to further contribute to its dissemination and promotion in analytical chemistry.
Key words

Full text: 1 Collection: 01-internacional Database: MEDLINE Language: En Journal: Anal Bioanal Chem Year: 2017 Type: Article

Full text: 1 Collection: 01-internacional Database: MEDLINE Language: En Journal: Anal Bioanal Chem Year: 2017 Type: Article