Evaluation of Machine Learning Models for Aqueous Solubility Prediction in Drug Discovery
S Liu, Y Zhang, N Xue - bioRxiv, 2024 - biorxiv.org
Determining the aqueous solubility of the chemical compound is of great importance in-silico
drug discovery. However, correctly and rapidly predicting the aqueous solubility remains a …
drug discovery. However, correctly and rapidly predicting the aqueous solubility remains a …