Commit graph

4 commits

Author SHA1 Message Date
chenyongkang
fb4009b871 fix(ChemStructure2Property): implement scoring system for logP prediction
- Add random selection of InChI and SMILES strings
- Implement relative error-based scoring for logP prediction
- Update verification functions to return scores instead of boolean
- Refactor InChI and SMILES generation for better randomness
2025-06-17 12:07:14 +08:00
chenyongkang
324d068f8d refactor(internbootcamp): standardize naming conventions and improve code structure
- Rename puzzle configuration files for consistency (e.g., InChI2logP_test.json)
- Standardize class names to PascalCase (e.g., InChI2MRBootCamp -> InChI2MRbootCamp)
- Improve code structure in various bootcamp modules for better readability and maintainability
- Update import statements and file references to reflect new naming conventions
- Enhance setup.py to include rdkit dependency
2025-06-16 20:49:17 +08:00
Jucheng Hu
f0255839e2 switch to normalized error verify 2025-06-16 15:15:01 +08:00
Jucheng Hu
91972f43ea adding MR and LogP Prediction tasks 2025-06-16 15:10:05 +08:00