Chemoinformatics Laboratory

Welcome to the Chemoinformatics Laboratory

Exploring the Intersections of Chemistry and Information Science.

About Our Lab

The Chemoinformatics Laboratory, led by Dr. J. Zhang, focuses on the development and application of computational tools to solve complex problems in chemical and biological sciences. Our interdisciplinary team combines expertise in chemistry, biology, computer science, and data analytics to advance the drug design.

Research Areas

  • Machine Learning in Drug Discovery
  • Molecular Dynamics and Simulation
  • Chemical Data Analysis and Visualization
  • Computational Methods for Food Science

Recent Achievements

We are proud to announce that our recent study on "AI-driven Synthesis Prediction" has been published in the Journal of Computational Chemistry, highlighting a breakthrough in predictive modeling for organic synthesis.

Join Our Team

We are always looking for passionate researchers and students to join our lab. If you are interested in chemoinformatics and computational chemistry, please contact us.

Contact Us


Address: Guizhou Medical University, Guiyang 550025, China