QSAR Modeling with Multiple Algorithms: MLR, PLS, and Random Forest

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Documentation for package ‘rQSAR’ version 1.0.0

• DESCRIPTION file.
• User guides, package vignettes and other documentation.

Help Pages

build_qsar_models	Build QSAR models with k-fold cross-validation
correlation_plots	Create correlation plots for QSAR models
generate_descriptors_from_sdf	Generate Molecular Descriptors from SDF File
perform_variable_selection	Perform variable selection using regression subsets
residual_plots	Function to create residual plots with model type labels