Effects of Class Imbalance and Data Scarcity on the Performance of Binary Classification Machine Learning Models Developed Based on ToxCast/Tox21 Assay Data by Changhun Kim (682542)

“…Thirty models established by combining five molecular fingerprints (i.e., Morgan, MACCS, RDKit, Pattern, and Layered) and six algorithms [i.e., gradient boosting tree, random forest (RF), multi-layered perceptron, <i>k</i>-nearest neighbor, logistic regression, and naive Bayes] were trained using the selected assay data set. …”

Testing algorithm for modified 2-tiered approaches to Lyme disease diagnosis. by Richard Porwancher (11413931)

Machine Learning-Ready Dataset for Cytotoxicity Prediction of Metal Oxide Nanoparticles by Soham Savarkar (21811825)

“…</p><p dir="ltr">Encoding: Categorical variables such as surface coating and cell type were grouped into logical classes and label-encoded to enable model compatibility.</p><p dir="ltr"><b>Applications and Model Compatibility:</b></p><p dir="ltr">The dataset is optimized for use in supervised learning workflows and has been tested with algorithms such as:</p><p dir="ltr">Gradient Boosting Machines (GBM),</p><p dir="ltr">Support Vector Machines (SVM-RBF),</p><p dir="ltr">Random Forests, and</p><p dir="ltr">Principal Component Analysis (PCA) for feature reduction.…”