Reaction Data Reorganize - Githubissues

open-mol / bioagent

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Reaction Data Reorganize #1

Open CiaoHe opened 6 months ago

CiaoHe commented 6 months ago

Current Tasks:

Forward
Retro
Reaction Condition prediction
Reaction type classification
Yields Regression

Now only contains 3 tasks' dataset

Forward
- Mol-Instruction Forward dataset
- Mol-Instruction Forward dataset + Augment with T5Chem Forward Prediction dataset (src from USPTO-MIT)
Retro
- Mol-Instruction Retro dataset
Reagent Prediction
- Mol-Instruction Reagent dataset