upload intellifold_v2.py
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- .gitattributes +0 -1
- README.md +8 -30
- ccd_v2.pkl +0 -3
- intellifold_v2.pt +0 -3
- pdb_seqres_2022_09_28.fasta +0 -3
.gitattributes
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README.md
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- chemistry
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- biomolecular-structure-prediction
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- IntelliFold
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library_name: intellifold
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---
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<div align="center" style="margin: 20px 0;">
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<span style="margin: 0 10px;">β‘ <a href="https://server.intfold.com">IntelliFold Server</a></span>
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• <span style="margin: 0 10px;">π <a href="https://
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</div>
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## π New Model Release
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- **2026-02-07**: We are excited to present [[IntelliFold 2]](assets/Intellifold_v2_release_note.pdf). This version represents a
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major architectural update and is one of the first open-source models to outperform AlphaFold3 on
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Foldbench.
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## π Benchmarking
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To comprehensively evaluate the performance of IntelliFold 2, we conducted a rigorous evaluation on [FoldBench](https://github.com/BEAM-Labs/FoldBench). We compared IntelliFold against several leading methods, including [Boltz-1,2](https://github.com/jwohlwend/boltz), [Chai-1](https://github.com/chaidiscovery/chai-lab), [Protenix](https://github.com/bytedance/Protenix) and [Alphafold3](https://github.com/google-deepmind/alphafold3).
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For more details on the benchmarking process and results, please refer to our release note [IntelliFold 2 Release Note](https://raw.githubusercontent.com/IntelliGen-AI/IntelliFold/main/assets/Intellifold_v2_release_note.pdf) and [IntelliFold Technical Report](https://arxiv.org/abs/2507.02025).
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## π Quick Start
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intellifold predict your_input.yaml --out_dir ./results
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```
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IntelliFold v2-Flash will be used by default, you can also use IntelliFold v2 by specifying the model name:
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```bash
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intellifold predict your_input.yaml --out_dir ./results --model v2
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```
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3. **Check Results**: Find predicted structures and confidence scores in the output directory, you can also check the section of **output format** in [output documentation](https://github.com/IntelliGen-AI/IntelliFold/blob/main/docs/input_yaml_format.md#output-format).
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4. **Optional Optimization**: Enable [custom kernels](https://github.com/IntelliGen-AI/IntelliFold/blob/main/docs/kernels.md) for faster inference and reduced memory usage
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For comprehensive usage instructions and examples, refer to the [Usage Guide](https://github.com/IntelliGen-AI/IntelliFold/blob/main/docs/usage.md).
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## π IntelliFold Server
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If you use IntelliFold in your research, please cite our paper:
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```
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@techreport{qiao2026intellifold,
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title={{IntelliFold 2: Surpassing AlphaFold 3 via Architectural Refinement and Structural Consistency}},
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author={Lifeng Qiao and He Yan and Gary Liu and Gaoxing Guo and Siqi Sun},
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year={2026},
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institution={IntelliGen-AI},
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type={Release Note},
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url={https://raw.githubusercontent.com/IntelliGen-AI/IntelliFold/main/assets/Intellifold_v2_release_note.pdf}
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}
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@misc{theintfoldteam2025intfoldcontrollablefoundationmodel,
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title={IntFold: A Controllable Foundation Model for General and Specialized Biomolecular Structure Prediction},
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author={The IntFold Team and Leon Qiao and Wayne Bai and He Yan and Gary Liu and Nova Xi and Xiang Zhang},
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- chemistry
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- biomolecular-structure-prediction
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- IntelliFold
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---
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<div align="center" style="margin: 20px 0;">
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<span style="margin: 0 10px;">β‘ <a href="https://server.intfold.com">IntelliFold Server</a></span>
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• <span style="margin: 0 10px;">π <a href="https://arxiv.org/abs/2507.02025">Technical Report</a></span>
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</div>
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## π Quick Start
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intellifold predict your_input.yaml --out_dir ./results
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```
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3. **Check Results**: Find predicted structures and confidence scores in the output directory, you can also check the section of **output format** in [output documentation](https://github.com/IntelliGen-AI/IntelliFold/blob/main/docs/input_yaml_format.md#output-format).
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4. **Optional Optimization**: Enable [custom kernels](https://github.com/IntelliGen-AI/IntelliFold/blob/main/docs/kernels.md) for faster inference and reduced memory usage
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For comprehensive usage instructions and examples, refer to the [Usage Guide](https://github.com/IntelliGen-AI/IntelliFold/blob/main/docs/usage.md).
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## π Benchmarking
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To comprehensively evaluate the performance of To quickly get started with IntelliFold, you can use the following commands:
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, we conducted a rigorous evaluation on [FoldBench](https://github.com/BEAM-Labs/FoldBench). We compared IntelliFold against several leading methods, including [Boltz-1,2](https://github.com/jwohlwend/boltz), [Chai-1](https://github.com/chaidiscovery/chai-lab), [Protenix](https://github.com/bytedance/Protenix) and [Alphafold3](https://github.com/google-deepmind/alphafold3).
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For more details on the benchmarking process and results, please refer to our [Technical Report](https://arxiv.org/abs/2507.02025).
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## π IntelliFold Server
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If you use IntelliFold in your research, please cite our paper:
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```
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@misc{theintfoldteam2025intfoldcontrollablefoundationmodel,
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title={IntFold: A Controllable Foundation Model for General and Specialized Biomolecular Structure Prediction},
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author={The IntFold Team and Leon Qiao and Wayne Bai and He Yan and Gary Liu and Nova Xi and Xiang Zhang},
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