The 2024 Nobel Prize in Chemistry was recently granted to David Baker, Demis Hassabis and John M. Jumper, renowned for their pioneering works in protein design. In addition, Nature has recently ...

As an emerging technology in the field of artificial intelligence (AI), graph neural networks (GNNs) are deep learning models designed to process graph-structured data. Currently, GNNs are effective ...

The multiple condition (MC)-retention model is an uncertainty-aware graph-based neural network that predicts liquid chromatography (LC) retention times across multiple column chem ...

The increasing complexity of modern chemical engineering processes presents significant challenges for timely and accurate anomaly detection. Traditional ...