International Digital Economy Academy AI4SCI

non-profit

https://github.com/IDEA-XL

AI & ML interests

Open Molecular Related Datasets and Models

Recent Activity

penguindaddy updated a dataset about 5 hours ago

IDEA-AI4S/RxnPatent

hcaoaf authored a paper about 22 hours ago

Agentic reinforcement learning empowers next-generation chemical language models for molecular design and synthesis

hcaoaf authored a paper about 22 hours ago

From Static Structures to Ensembles: Studying and Harnessing Protein Structure Tokenization

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IDEA-AI4S 's datasets 59

IDEA-AI4S/RxnPatent

Updated about 5 hours ago • 1

IDEA-AI4S/ChemO

Viewer • Updated about 23 hours ago • 74

IDEA-AI4S/ChemCoTDataset

Viewer • Updated about 1 month ago • 28.3k • 153 • 9

IDEA-AI4S/ChemCoTBench

Viewer • Updated Nov 24, 2025 • 1.5k • 717 • 10

IDEA-AI4S/DD100

Viewer • Updated Oct 11, 2025 • 93 • 7

IDEA-AI4S/chemreason_retro

Preview • Updated Apr 9, 2025 • 10

IDEA-AI4S/rxn_mech

Updated Apr 2, 2025

IDEA-AI4S/MoleculeQA

Viewer • Updated Nov 26, 2024 • 985k • 48 • 4

IDEA-AI4S/MolInst_RS_125K_Scaffold_SMILES-MMChat

Viewer • Updated Nov 4, 2024 • 130k • 31 • 1

IDEA-AI4S/MolInst_FS_125K_Scaffold_SMILES-MMChat

Viewer • Updated Nov 4, 2024 • 125k • 34

IDEA-AI4S/SMol_RS_Filtered_825K_SMILES-MMChat

Viewer • Updated Nov 4, 2024 • 829k • 84

IDEA-AI4S/SMol_FS_Filtered_875K_SMILES-MMChat

Viewer • Updated Nov 4, 2024 • 877k • 11

IDEA-AI4S/RCR_SP_70K_SMILES-MMChat

Viewer • Updated Nov 4, 2024 • 86.5k • 12

IDEA-AI4S/RCR_RP_57K_SMILES-MMChat

Viewer • Updated Nov 4, 2024 • 69.8k • 12

IDEA-AI4S/RCR_CP_10K_SMILES-MMChat

Viewer • Updated Nov 4, 2024 • 12.3k • 46 • 1

IDEA-AI4S/USPTO_RXN_Interleaved

Viewer • Updated Oct 22, 2024 • 1.59M • 6 • 1

IDEA-AI4S/LPM-24_caption_extra-SFT

Viewer • Updated May 28, 2024 • 825k • 8

IDEA-AI4S/LPM-24_caption-SFT

Viewer • Updated May 28, 2024 • 183k • 7 • 1

IDEA-AI4S/LPM-24_molgen_extra-SFT

Viewer • Updated May 28, 2024 • 825k • 7 • 1

IDEA-AI4S/LPM-24_molgen-SFT

Viewer • Updated May 28, 2024 • 182k • 6

IDEA-AI4S/LPM-24_molgen_extra-MMChat

Viewer • Updated May 28, 2024 • 825k • 7 • 1

IDEA-AI4S/LPM-24_molgen-MMChat

Viewer • Updated May 28, 2024 • 182k • 23

IDEA-AI4S/LPM-24_caption_extra-MMChat

Viewer • Updated May 27, 2024 • 825k • 9

IDEA-AI4S/LPM-24_caption-MMChat

Viewer • Updated May 27, 2024 • 183k • 5

IDEA-AI4S/MolInst_125K_Scaffold_RS_SMILES-SFT

Viewer • Updated May 15, 2024 • 130k • 11 • 1

IDEA-AI4S/MolInst_125K_Scaffold_FS_SMILES-SFT

Viewer • Updated May 15, 2024 • 125k • 10 • 3

IDEA-AI4S/SMol_RS_Filtered_825K_SMILES-SFT

Viewer • Updated Apr 26, 2024 • 829k • 7

IDEA-AI4S/HTE_4K_RAS-SFT

Viewer • Updated Apr 26, 2024 • 4.26k • 4

IDEA-AI4S/BH-SM_10K_YR-SFT

Viewer • Updated Apr 26, 2024 • 9.72k • 7

IDEA-AI4S/SMol_FS_Filtered_875K_SMILES-SFT

Viewer • Updated Apr 26, 2024 • 877k • 9 • 1