This is the repository that contains source code for the DrugImprover website.
If you find DrugImprover useful for your work please cite:
@inproceedings{
liu2023drugimprover,
title={DrugImprover: Utilizing Reinforcement Learning for Multi-Objective Alignment in Drug Optimization},
author={Xuefeng Liu and Songhao Jiang and Archit Vasan and Alexander Brace and Ozan Gokdemir and Thomas Brettin and Fangfang Xia and Ian Foster and Rick Stevens},
booktitle={NeurIPS 2023 Workshop on New Frontiers of AI for Drug Discovery and Development},
year={2023},
url={https://openreview.net/forum?id=8RPbtOC6Sl}
}
This work is licensed under a Creative Commons Attribution-ShareAlike 4.0 International License.
