Download - 5 data analysis case study
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Biology
Chemistry
Informatics
Comparison of pumpkin and tomatillo leaf primary metabolites
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Goal:Carry out a statistical, HCA, PCA and O-/PLS-DA
analyses comparing leaf primary metabolite profiles(Used DATA: Pumpkin and Tomatillo 1.csv)
Physalis philadelphicaCucurbita pepo
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Biology
Chemistry
Informatics
Comparison of pumpkin and tomatillo leaf primary metabolites
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1.Identify analysis strategy (hint: use HCA and PCA)
2.Conduct statistical comparison3.Identify top multivariate discriminants
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Biology
Chemistry
Informatics
Data ExplorationCo
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Steps:1. Identify the effect of treatment on species differences
• Use HCA• PCA
Exercise:Can different treatments be analyzed together to
identify species differences?
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Biology
Chemistry
Informatics
HCA clustering of samplesCo
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Biology
Chemistry
Informatics
PCA: comparison of pretreatments
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ites raw Mean centered Auto scaled
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Biology
Chemistry
Informatics
Identify Analysis Strategy
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Analysis Options:
If the treatment is a minor effect compared to species differences:
• two-sample t-Test for Species
If the treatment is a has a considerable effect compared to species differences:
• two-way ANOVA for Species + treatment + interaction (species/treatment)
If the treatment has a similar effect size to species differences:
• Eliminate one treatment type from analysis and use t-Test
Conclusions:
• Both PCA and HCA analyses suggests the treatment effect is minor
• Using 12 compared to 6 samples per group will increased study power
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Biology
Chemistry
Informatics
Comparison PLS-DA to O-PLS-DACo
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PLS-DA O-PLS-DA
O-PLS-DA is only useful over PLS-DA when the axis of separation between two groups spans >1 dimension
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Biology
Chemistry
Informatics
Validation of PLS-DA model for discrimination between pumpkin and tomatillo leaf metabolites
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Outstanding model performance, highly unlikely by random chance
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Biology
Chemistry
Informatics
Identification of top multivariate discriminants between pumpkin and tomatillo leaf primary metabolites
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Could also select from increasing and decreasing metabolites separately