GWP-project

cite as: Leveraging Machine Learning to Predict the ****

• Website for predicting GWP and AL 👉 click
• Prof. Chung: [email protected]
  Yang Changwon: [email protected] (DFT)
  Guobin Zhao: [email protected] (machine learning)
  Kim, Haewon: [email protected] (make figure,machine learning, DFT)

Machine learning

⭐ trainer: codes, notebook, dataset, models used for machine learning training
⭐ predicter: codes, notebook, example dataset, models used for predicting
⭐ pre-trainer: codes, notebook, dataset for pretarin and get top 10 features from 214 features (211 from RDKit,3 from DFT)
⭐ final-predicter: codes, notebook, example dataset, models used for predicting using final best models.

Group: Molecular Thermodynamics & Advance Processes Laboratory