Page 73 - Veritas Vol 3, Issue 2
P. 73

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             as dimension, model accuracy, etc. PLSR (Partial Least Square Regression) is
             also another notable method which is largely helpful in cases of differentiating

             authentic and counterfeit products.



             2.2 Experimental Design Techniques
             The result of any chemometric method largely depends on the input data that
             has been put in the beginning. Choosing the required parameters and analytical

             data  from  large  sample  evidences  with  at  most  care  is  crucial  for  the  final
             output.  Here  comes  the  role  of  Experimental  Design  Techniques,  offering

             various  tools  and  techniques  such  as  sample  preparation,  sample  storage,
             parameters for instrumental analysis, etc. which helps in identifying, optimising

             data  and  modelling  factors  that  are  involved  in  effective  completion  of  the
             process.



             3. APPLICATION IN FORENSIC SCIENCE



                  Identifying impurities and contaminants in Drugs and Pharmaceuticals, one
                  of the most important fields of application.

                  Chemometrics  combined  with  spectroscopy  such  as  ATR-FTIR
                  spectroscopy.

                  Utilising  chemometrics  in  acquiring  more  accurate  results  in  analysing
                  seized rugs with techniques such as DR-NIR spectroscopy and PLSR.

                  Identifying source and quantifying cocaine samples.
                  Detecting counterfeit products, etc.



             4. DRAWBACKS OF CHEMOMETRICS



                  It is quantitative in nature.
                  One cannot predict what is present.
                  Majorly used only for visualisation of data.

                  Subjectivity in data evaluation.
                  Uncertainty estimation.

                  Multicollinearity and Model Complexity, etc.








     VERITAS VOLUME: 3, ISSUE: 2                                            WRITER: R V ISHITHA REDDY
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