Author

Jieyu Jin

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#computer vision Oct 2025

ECloudGen: leveraging electron clouds as a latent variable to scale up structure-based molecular design

This study presents ECloudGen, which uses latent diffusion to generate electron clouds from protein pockets and decodes them into molecules, and adopts two-stage training, which expands the chemical space accessible to generative drug design.

Odin Zhang, Jieyu Jin, Zhenxing Wu et al. · Nature Computational Science · 4 citations

#computer vision Review May 2026

Comprehensive Assessment and Benchmark of Deep Generative Models for Proteolysis TArgeting Chimera (PROTAC) Design

This work aims to discuss the features and the generative performance of different types of molecular generative models for the PROTAC design task and help researchers to better apply these models in practical cases.

Jieyu Jin, Tingjun Hou, Huanxiang Liu et al. · Journal of Chemical Informat... · 0 citations