The-Chuong Trinh

The-Chuong Trinh

Pharmacist and Master's degree holder in BioHealth Engineering with expertise in applying Machine Learning/Deep Learning methodologies to Computer-Aided Drug Discovery, Cheminformatics, and Bioinformatics.

CADD packages

MolUtil

MolUtil is an automated pipeline for molecular standardization, featurization into molecular descriptors and fingerprints, medicinal chemistry filtration, and chemical space visualization

MLQSAR

Mlqsar is a comprehensive automated QSAR workflow facilitating benchmark analysis and data category selection via rigorous statistical evaluation

MolAD

MolAD helps identify the applicability domain of QSAR models using PCA or MDS dimension reduction with the convex hull.

Statistical_test

Statistical test improves decision-making in comparing machine learning models’ performance by implementing statistical tests, including Bayesian estimation and the Wilcoxon signed-rank test