Display of the web prediction interface. by Meng Cao (105914)

“…The optimal model was further assessed for predictor importance utilizing the SHAP method and deployed on a web platform using the Streamlit library.…”

Random forest with hyperparameter optimization. by Balraj Preet Kaur (20370832)

Best optimizer results for random forest. by Balraj Preet Kaur (20370832)

Best optimizer results of Random Forest. by Balraj Preet Kaur (20370832)

Results of Random Forest. by Balraj Preet Kaur (20370832)

SHAP bar plot. by Meng Cao (105914)

“…The optimal model was further assessed for predictor importance utilizing the SHAP method and deployed on a web platform using the Streamlit library.…”

Sample screening flowchart. by Meng Cao (105914)

“…The optimal model was further assessed for predictor importance utilizing the SHAP method and deployed on a web platform using the Streamlit library.…”

Descriptive statistics for variables. by Meng Cao (105914)

“…The optimal model was further assessed for predictor importance utilizing the SHAP method and deployed on a web platform using the Streamlit library.…”

SHAP summary plot. by Meng Cao (105914)

“…The optimal model was further assessed for predictor importance utilizing the SHAP method and deployed on a web platform using the Streamlit library.…”

ROC curves for the test set of four models. by Meng Cao (105914)

“…The optimal model was further assessed for predictor importance utilizing the SHAP method and deployed on a web platform using the Streamlit library.…”

Diversity and specificity of lipid patterns in basal soil food web resources by Jakob Kühn (7288466)

“…In marine environments, multivariate optimization models (Quantitative Fatty Acid Signature Analysis) and Bayesian approaches (source-tracking algorithm) were established to predict the proportion of predator diets using lipids as tracers. …”

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)

“…Therefore, the resampling algorithm employed should vary depending on the data distribution to achieve optimal classification performance. …”

QSAR model for predicting neuraminidase inhibitors of influenza A viruses (H1N1) based on adaptive grasshopper optimization algorithm by Z.Y. Algamal (5547620)

“…Obtaining a reliable QSAR model with few descriptors is an essential procedure in chemometrics. The binary grasshopper optimization algorithm (BGOA) is a new meta-heuristic optimization algorithm, which has been used successfully to perform feature selection. …”

iRaPCA and SOMoC: Development and Validation of Web Applications for New Approaches for the Clustering of Small Molecules by Denis N. Prada Gori (5798651)

“…Here, two open-source in-house methodologies for clustering of small molecules are presented: iterative Random subspace Principal Component Analysis clustering (iRaPCA), an iterative approach based on feature bagging, dimensionality reduction, and K-means optimization; and Silhouette Optimized Molecular Clustering (SOMoC), which combines molecular fingerprints with the Uniform Manifold Approximation and Projection (UMAP) and Gaussian Mixture Model algorithm (GMM). …”

iRaPCA and SOMoC: Development and Validation of Web Applications for New Approaches for the Clustering of Small Molecules by Denis N. Prada Gori (5798651)

“…Here, two open-source in-house methodologies for clustering of small molecules are presented: iterative Random subspace Principal Component Analysis clustering (iRaPCA), an iterative approach based on feature bagging, dimensionality reduction, and K-means optimization; and Silhouette Optimized Molecular Clustering (SOMoC), which combines molecular fingerprints with the Uniform Manifold Approximation and Projection (UMAP) and Gaussian Mixture Model algorithm (GMM). …”

iRaPCA and SOMoC: Development and Validation of Web Applications for New Approaches for the Clustering of Small Molecules by Denis N. Prada Gori (5798651)

“…Here, two open-source in-house methodologies for clustering of small molecules are presented: iterative Random subspace Principal Component Analysis clustering (iRaPCA), an iterative approach based on feature bagging, dimensionality reduction, and K-means optimization; and Silhouette Optimized Molecular Clustering (SOMoC), which combines molecular fingerprints with the Uniform Manifold Approximation and Projection (UMAP) and Gaussian Mixture Model algorithm (GMM). …”

Random forest model performs better than support vector machine algorithms and when it primarily uses spontaneous photopic ERG of 60-s duration in humans. by Ramsés Noguez Imm (6658637)

Flowchart scheme of the ML-based model. by Noshaba Qasmi (20405009)

“…<b>I)</b> Testing data consisting of 20% of the entire dataset. <b>J)</b> Optimization of hyperparameter tuning. <b>K)</b> Algorithm selection from all models. …”

Supplementary file 1_Comparative evaluation of fast-learning classification algorithms for urban forest tree species identification using EO-1 hyperion hyperspectral imagery.docx by Veera Narayana Balabathina (22518524)

“…</p>Methods<p>Thirteen supervised classification algorithms were comparatively evaluated, encompassing traditional spectral/statistical classifiers—Maximum Likelihood, Mahalanobis Distance, Minimum Distance, Parallelepiped, Spectral Angle Mapper (SAM), Spectral Information Divergence (SID), and Binary Encoding—and machine learning algorithms including Decision Tree (DT), K-Nearest Neighbor (KNN), Support Vector Machine (SVM), Random Forest (RF), and Artificial Neural Network (ANN). …”

Spontaneous ERG-based random forest model discriminates control and disease cases in rodent models of obesity and type 1 diabetes and predicts disease evolution in the type 1 diabe... by Ramsés Noguez Imm (6658637)