calc_RI | Calculate Van Den Dool and Kratz Retention Indicies |
calc_RT | Back-calculate Retention Times |
chem_scale | Scaling Functions for Metabolomics |
get_loadings | Get axis loadings from models created by 'ropls::opls()' |
get_modelinfo | Retrieve model parameters from models created by... |
get_plotdata | Extract data for plotting (O)PLS(-DA) data with ggplot2 |
get_scores | Get axis scores from models created by 'ropls::opls()'... |
get_VIP | Get VIP scores from PLS and OPLS models created by... |
parse_IA | Parse IonAnalytics CSV files |
plot_opls | Plot OPLS regression models produced by 'ropls::opls()' |
plot_oplsda | Plot OPLS-DA models produced by 'ropls::opls()' |
plot_pca | Plot PCA models created by 'ropls::opls()' |
plot_pls | Plot PLS regression models produced by 'ropls::opls()' |
plot_plsda | Plot PLS-DA models produced by 'ropls::opls()' |
read_IA | Read IonAnalytics CSV files |
VDDK_RI | Calculate a single Van Den Dool and Kratz Retention Index |
VDDK_RT | Calculate a single retention time given a Van Den Dool and... |
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