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Umetrics simca 17.0
Simca 17.0, supplied by Umetrics, used in various techniques. Bioz Stars score: 90/100, based on 1 PubMed citations. ZERO BIAS - scores, article reviews, protocol conditions and more
https://www.bioz.com/product/simca+17%2E0/simca+software/pmc12281066-166-11-13
Average 90 stars, based on 1 article reviews
simca 17.0 - by Bioz Stars, 2026-10
90/100 stars

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Article Title: Identification of lipid biomarkers at different stages of breast cancer by rapid evaporative ionization mass spectrometry (REIMS) using syngeneic balb/c mice breast cancer model.
Article Snippet: Lipid metabolite profiling of different phases, i.e., early phase (EP) and metastatic phase, was carried out to find out potential lipid biomarkers in breast cancer.. Breast cancer was induced using 4T1 cells in a syngeneic mice model using balb/c mice.. Rapid Evaporative Ionization Mass Spectrometry (REIMS) was employed to elucidate the lipid biomarker profile.

Article Title: Key molecular compounds for simultaneous origin discrimination and sensory prediction of cocoa: An UHPLC-HRMS sensomics approach.
Article Snippet: Regarding statistic approaches, SIMCA 17.0 (Umetrics, Sweden) was used for multivariate analysis, starting from the unsupervised approach Principal Component Analysis (PCA), and continuing with supervised Orthogonal Partial Least Squares-Discriminant Analysis (OPLS-DA), interpreting the score plot and the hierarchical clustering, to identify the possible groupings and discriminations of the observations.

Article Title: Sleep health associations with serum metabolites in healthy adults
Article Snippet: Prior to further analysis, unsupervised principal component analysis (PCA) was applied (Simca 17.0, Umetrics, Umeå, Sweden) to check data homogeneity, and to identify outliers based on samples’ metabolic similarities and dissimilarities.

Article Title: Comprehensive two dimensional gas chromatography - time of flight mass spectrometry (GC×GC-TOFMS) for the investigation of botanical origin of raw spirits.
Article Snippet: Comprehensive two dimensional gas chromatography – time of flight mass spectrometry (GC × GC-TOFMS) with sample introduction using headspace solid phase microextraction (HS-SPME) was used for the botanical classification of raw spirits obtained from C3 (corn and sorghum) and C4 (rye, wheat and potato) plants.. 45 spirit samples representing these raw materials (10 spirits produced from rye, corn, wheat and potato, and 5 from sorghum) were analyzed.. Volatile compounds profiles were compared by PCA, and after removal of outliers samples were subjected to the classification model. OPLS-DA model was built (R2Y = 0.924 Q2Y = 0.895) that enabled clear separation of all tested spirits of different botanical origin.

Article Title: Distribution of the free and base-bound polyphenols from kernels, cakes and oils of Camellia oleifera seeds: Impact of different shell ratios during pressing.
Article Snippet: This study integrated non-targeted metabolomics with chemometric analyses to dissect the impact of varying shell ratios on the distribution of free (FP) and base-bound (BP) polyphenols from C. oleifera seeds during pressing.. We quantified a comprehensive 209-parameter set, encompassing 177 individual polyphenols, via UPLC Q-TOF MS, and analyzed the data using multivariate statistical techniques.. PCA model exposed intrinsic variability, while OPLS-DA model effectively distinguished the pairwise comparison samples, revealing 23 differential polyphenols with VIP scores >1 and P-value <0.05.

Article Title: Conversion of glutamate into proline by the leucine analog BCH enhances biphasic insulin secretion in pancreatic β-cells.
Article Snippet: Metabolite peak areas were analyzed using SIMCA 17.0 (Umetrics AB, Umeå, Sweden), meancentered, UV-scaled, and subjected to principal component analysis (PCA) and OPLS-DA.

Article Title: Conversion of glutamate into proline by the leucine analog BCH enhances biphasic insulin secretion in pancreatic β-cells
Article Snippet: Metabolite peak areas were analyzed using SIMCA 17.0 (Umetrics AB), mean-centered, UV-scaled, and subjected to principal component analysis and OPLS-DA.

Transformation Assay:

Article Title: Identification of lipid biomarkers at different stages of breast cancer by rapid evaporative ionization mass spectrometry (REIMS) using syngeneic balb/c mice breast cancer model.
Article Snippet: Lipid metabolite profiling of different phases, i.e., early phase (EP) and metastatic phase, was carried out to find out potential lipid biomarkers in breast cancer.. Breast cancer was induced using 4T1 cells in a syngeneic mice model using balb/c mice.. Rapid Evaporative Ionization Mass Spectrometry (REIMS) was employed to elucidate the lipid biomarker profile.

Article Title: Key molecular compounds for simultaneous origin discrimination and sensory prediction of cocoa: An UHPLC-HRMS sensomics approach.
Article Snippet: Regarding statistic approaches, SIMCA 17.0 (Umetrics, Sweden) was used for multivariate analysis, starting from the unsupervised approach Principal Component Analysis (PCA), and continuing with supervised Orthogonal Partial Least Squares-Discriminant Analysis (OPLS-DA), interpreting the score plot and the hierarchical clustering, to identify the possible groupings and discriminations of the observations.

Article Title: Sleep health associations with serum metabolites in healthy adults
Article Snippet: Prior to further analysis, unsupervised principal component analysis (PCA) was applied (Simca 17.0, Umetrics, Umeå, Sweden) to check data homogeneity, and to identify outliers based on samples’ metabolic similarities and dissimilarities.

Article Title: Comprehensive two dimensional gas chromatography - time of flight mass spectrometry (GC×GC-TOFMS) for the investigation of botanical origin of raw spirits.
Article Snippet: Comprehensive two dimensional gas chromatography – time of flight mass spectrometry (GC × GC-TOFMS) with sample introduction using headspace solid phase microextraction (HS-SPME) was used for the botanical classification of raw spirits obtained from C3 (corn and sorghum) and C4 (rye, wheat and potato) plants.. 45 spirit samples representing these raw materials (10 spirits produced from rye, corn, wheat and potato, and 5 from sorghum) were analyzed.. Volatile compounds profiles were compared by PCA, and after removal of outliers samples were subjected to the classification model. OPLS-DA model was built (R2Y = 0.924 Q2Y = 0.895) that enabled clear separation of all tested spirits of different botanical origin.

Article Title: Distribution of the free and base-bound polyphenols from kernels, cakes and oils of Camellia oleifera seeds: Impact of different shell ratios during pressing.
Article Snippet: This study integrated non-targeted metabolomics with chemometric analyses to dissect the impact of varying shell ratios on the distribution of free (FP) and base-bound (BP) polyphenols from C. oleifera seeds during pressing.. We quantified a comprehensive 209-parameter set, encompassing 177 individual polyphenols, via UPLC Q-TOF MS, and analyzed the data using multivariate statistical techniques.. PCA model exposed intrinsic variability, while OPLS-DA model effectively distinguished the pairwise comparison samples, revealing 23 differential polyphenols with VIP scores >1 and P-value <0.05.

Article Title: Conversion of glutamate into proline by the leucine analog BCH enhances biphasic insulin secretion in pancreatic β-cells.
Article Snippet: Metabolite peak areas were analyzed using SIMCA 17.0 (Umetrics AB, Umeå, Sweden), meancentered, UV-scaled, and subjected to principal component analysis (PCA) and OPLS-DA.

Article Title: Conversion of glutamate into proline by the leucine analog BCH enhances biphasic insulin secretion in pancreatic β-cells
Article Snippet: Metabolite peak areas were analyzed using SIMCA 17.0 (Umetrics AB), mean-centered, UV-scaled, and subjected to principal component analysis and OPLS-DA.



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