XuhanLiu / DrugEx

Deep learning toolkit for Drug Design with Pareto-based Multi-Objective optimization in Polypharmacology
MIT License
189 stars 66 forks source link

how to use or simply start? any example? #20

Open lonngxiang opened 1 year ago

martin-sicho commented 1 year ago

You will find an updated and improved version of the code here: https://github.com/CDDLeiden/DrugEx. It also contains more extensive documentation and tutorials. I hope it helps!