datasets
Training and evaluation data, with the modality, task and licence stated up front. Listed live from the Hugging Face Hub.
EC_AlphaFold2
EC Dataset with AlphaFold2 Structural Sequence
Description: The Enzyme Commission number (EC number) is a numerical classification scheme for enzymes, based on the chemical reactions they catalyze.
Number of labels: 585
Problem Type: multi_label_classification
Columns:
aa_seq: protein amino acid sequence
foldseek_seq: foldseek 20 3di structural sequence
ss8_seq: DSSP 8 secondary structure sequence
Github
Simple, Efficient and Scalable Structure-aware Adapter… See the full description on the dataset page: https://huggingface.co/datasets/AI4Protein/EC_AlphaFold2.MetalIonBinding_AlphaFold2
MetalIonBinding Dataset with AlphaFold2 Structural Sequence
Description: Metal-binding proteins are proteins or protein domains that chelate a metal ion.
Number of labels: 2
Problem Type: single_label_classification
Columns:
aa_seq: protein amino acid sequence
foldseek_seq: foldseek 20 3di structural sequence
ss8_seq: DSSP 8 secondary structure sequence
ss3_seq: DSSP 3 secondary structure sequence
esm3_structure_seq: ESM3 structure sequence encoded by VQ-VAE
Github… See the full description on the dataset page: https://huggingface.co/datasets/AI4Protein/MetalIonBinding_AlphaFold2.Thermostability_AlphaFold2
Thermostability Dataset with AlphaFold2 Structural Sequence
Description: In materials science and molecular biology, thermostability is the ability of a substance to resist irreversible change in its chemical or physical structure, often by resisting decomposition or polymerization, at a high relative temperature.
Number of labels: 1
Problem Type: regression
Columns:
aa_seq: protein amino acid sequence
foldseek_seq: foldseek 20 3di structural sequence
ss8_seq: DSSP 8 secondary… See the full description on the dataset page: https://huggingface.co/datasets/AI4Protein/Thermostability_AlphaFold2.DeepLocBinary_AlphaFold2
DeepLocBinary Dataset with AlphaFold2 Structural Sequence
Description: Protein localization encompasses the processes that establish and maintain proteins at specific locations.
Number of labels: 2
Problem Type: single_label_classification
Columns:
aa_seq: protein amino acid sequence
foldseek_seq: foldseek 20 3di structural sequence
ss8_seq: DSSP 8 secondary structure sequence
location: On the membrane or not
Github
Simple, Efficient and Scalable Structure-aware… See the full description on the dataset page: https://huggingface.co/datasets/AI4Protein/DeepLocBinary_AlphaFold2.GO_MF_AlphaFold2
GO-MF Dataset with AlphaFold2 Structural Sequence
Description: Molecular Function of Gene Ontology (GO) project.
Number of labels: 489
Problem Type: multi_label_classification
Columns:
aa_seq: protein amino acid sequence
foldseek_seq: foldseek 20 3di structural sequence
ss8_seq: DSSP 8 secondary structure sequence
Github
Simple, Efficient and Scalable Structure-aware Adapter Boosts Protein Language Models
https://github.com/tyang816/SES-Adapter
VenusFactory: A Unified… See the full description on the dataset page: https://huggingface.co/datasets/AI4Protein/GO_MF_AlphaFold2.GO_BP_AlphaFold2
GO-BP Dataset with AlphaFold2 Structural Sequence
Description: Biological Process of Gene Ontology (GO) project.
Number of labels: 1943
Problem Type: multi_label_classification
Columns:
aa_seq: protein amino acid sequence
foldseek_seq: foldseek 20 3di structural sequence
ss8_seq: DSSP 8 secondary structure sequence
Github
Simple, Efficient and Scalable Structure-aware Adapter Boosts Protein Language Models
https://github.com/tyang816/SES-Adapter
VenusFactory: A… See the full description on the dataset page: https://huggingface.co/datasets/AI4Protein/GO_BP_AlphaFold2.DeepLocMulti_AlphaFold2
DeepLocMulti Dataset with AlphaFold2 Structural Sequence
Description: Protein localization encompasses the processes that establish and maintain proteins at specific locations.
Number of labels: 10
Problem Type: single_label_classification
Columns:
aa_seq: protein amino acid sequence
foldseek_seq: foldseek 20 3di structural sequence
ss8_seq: DSSP 8 secondary structure sequence
location: Specific location
Github
Simple, Efficient and Scalable Structure-aware… See the full description on the dataset page: https://huggingface.co/datasets/AI4Protein/DeepLocMulti_AlphaFold2.GO_CC_AlphaFold2
GO-CC Dataset with AlphaFold2 Structural Sequence
Description: Cellular Component of Gene Ontology (GO) project.
Number of labels: 320
Problem Type: multi_label_classification
Columns:
aa_seq: protein amino acid sequence
foldseek_seq: foldseek 20 3di structural sequence
ss8_seq: DSSP 8 secondary structure sequence
Github
Simple, Efficient and Scalable Structure-aware Adapter Boosts Protein Language Models
https://github.com/tyang816/SES-Adapter
VenusFactory: A Unified… See the full description on the dataset page: https://huggingface.co/datasets/AI4Protein/GO_CC_AlphaFold2.eSOL_AlphaFold2
eSOL Dataset
Description: Solubility is a fundamental protein property that has important connotations for therapeutics and use in diagnosis.
Number of labels: 1
Problem Type: regression
Columns:
aa_seq: protein amino acid sequence
gene: gene id
Github
VenusFactory: A Unified Platform for Protein Engineering Data Retrieval and Language Model Fine-Tuning
https://github.com/ai4protein/VenusFactory
Citation
Please cite our work if you use our dataset.… See the full description on the dataset page: https://huggingface.co/datasets/AI4Protein/eSOL_AlphaFold2.GO_AlphaFold2_PDB
GO PDB Dataset
Github
Simple, Efficient and Scalable Structure-aware Adapter Boosts Protein Language Models
https://github.com/tyang816/SES-Adapter
VenusFactory: A Unified Platform for Protein Engineering Data Retrieval and Language Model Fine-Tuning
https://github.com/ai4protein/VenusFactory
Citation
Please cite our work if you use our dataset.
@article{tan2024ses-adapter,
title={Simple, Efficient, and Scalable Structure-Aware Adapter Boosts Protein Language… See the full description on the dataset page: https://huggingface.co/datasets/AI4Protein/GO_AlphaFold2_PDB.DeepLocMulti_AlphaFold2_PDB
DeepLocMulti PDB Dataset
Github
Simple, Efficient and Scalable Structure-aware Adapter Boosts Protein Language Models
https://github.com/tyang816/SES-Adapter
VenusFactory: A Unified Platform for Protein Engineering Data Retrieval and Language Model Fine-Tuning
https://github.com/ai4protein/VenusFactory
Citation
Please cite our work if you use our dataset.
@article{tan2024ses-adapter,
title={Simple, Efficient, and Scalable Structure-Aware Adapter Boosts… See the full description on the dataset page: https://huggingface.co/datasets/AI4Protein/DeepLocMulti_AlphaFold2_PDB.DeepLoc2Multi_AlphaFold2
DeepLoc2Multi_AlphaFold2 Dataset
Description: Protein localization encompasses the processes that establish and maintain proteins at specific locations.
Number of labels: 2
Problem Type: single_label_classification
Columns:
aa_seq: protein amino acid sequence
detail: meta information
Github
VenusFactory: A Unified Platform for Protein Engineering Data Retrieval and Language Model Fine-Tuning
https://github.com/ai4protein/VenusFactory
Citation
Please cite… See the full description on the dataset page: https://huggingface.co/datasets/AI4Protein/DeepLoc2Multi_AlphaFold2.SortingSignal_AlphaFold2
SortingSignal Dataset
Description: Protein sorting signal prediction.
Number of labels: 9
Problem Type: multi_label_classification
Columns:
aa_seq: protein amino acid sequence
Github
VenusFactory: A Unified Platform for Protein Engineering Data Retrieval and Language Model Fine-Tuning
https://github.com/ai4protein/VenusFactory
Citation
Please cite our work if you use our dataset.
@article{tan2025venusfactory,
title={VenusFactory: A Unified Platform for… See the full description on the dataset page: https://huggingface.co/datasets/AI4Protein/SortingSignal_AlphaFold2.MetalIonBinding_AlphaFold2_PDB
MetalIonBinding PDB Dataset
Github
Simple, Efficient and Scalable Structure-aware Adapter Boosts Protein Language Models
https://github.com/tyang816/SES-Adapter
VenusFactory: A Unified Platform for Protein Engineering Data Retrieval and Language Model Fine-Tuning
https://github.com/ai4protein/VenusFactory
Citation
Please cite our work if you use our dataset.
@article{tan2024ses-adapter,
title={Simple, Efficient, and Scalable Structure-Aware Adapter Boosts… See the full description on the dataset page: https://huggingface.co/datasets/AI4Protein/MetalIonBinding_AlphaFold2_PDB.Thermostability_AlphaFold2_PDB
Thermostability PDB Dataset
Github
Simple, Efficient and Scalable Structure-aware Adapter Boosts Protein Language Models
https://github.com/tyang816/SES-Adapter
VenusFactory: A Unified Platform for Protein Engineering Data Retrieval and Language Model Fine-Tuning
https://github.com/ai4protein/VenusFactory
Citation
Please cite our work if you use our dataset.
@article{tan2024ses-adapter,
title={Simple, Efficient, and Scalable Structure-Aware Adapter Boosts… See the full description on the dataset page: https://huggingface.co/datasets/AI4Protein/Thermostability_AlphaFold2_PDB.EC_AlphaFold2_PDB
EC PDB Dataset
Github
Simple, Efficient and Scalable Structure-aware Adapter Boosts Protein Language Models
https://github.com/tyang816/SES-Adapter
VenusFactory: A Unified Platform for Protein Engineering Data Retrieval and Language Model Fine-Tuning
https://github.com/ai4protein/VenusFactory
Citation
Please cite our work if you use our dataset.
@article{tan2024ses-adapter,
title={Simple, Efficient, and Scalable Structure-Aware Adapter Boosts Protein Language… See the full description on the dataset page: https://huggingface.co/datasets/AI4Protein/EC_AlphaFold2_PDB.DeepET_Topt_AlphaFold2_PDB
Github
VenusFactory: A Unified Platform for Protein Engineering Data Retrieval and Language Model Fine-Tuning
https://github.com/ai4protein/VenusFactory
Citation
Please cite our work if you use our dataset.
@article{tan2025venusfactory,
title={VenusFactory: A Unified Platform for Protein Engineering Data Retrieval and Language Model Fine-Tuning},
author={Tan, Yang and Liu, Chen and Gao, Jingyuan and Wu, Banghao and Li, Mingchen and Wang, Ruilin and Zhang, Lingrong and… See the full description on the dataset page: https://huggingface.co/datasets/AI4Protein/DeepET_Topt_AlphaFold2_PDB.VenusX_Dom_AlphaFold2_PDBDeepLocBinary_AlphaFold2_PDB
DeepLocBinary PDB Dataset
Github
Simple, Efficient and Scalable Structure-aware Adapter Boosts Protein Language Models
https://github.com/tyang816/SES-Adapter
VenusFactory: A Unified Platform for Protein Engineering Data Retrieval and Language Model Fine-Tuning
https://github.com/ai4protein/VenusFactory
Citation
Please cite our work if you use our dataset.
@article{tan2024ses-adapter,
title={Simple, Efficient, and Scalable Structure-Aware Adapter Boosts… See the full description on the dataset page: https://huggingface.co/datasets/AI4Protein/DeepLocBinary_AlphaFold2_PDB.eSOL_AlphaFold2_PDB
Github
VenusFactory: A Unified Platform for Protein Engineering Data Retrieval and Language Model Fine-Tuning
https://github.com/ai4protein/VenusFactory
Citation
Please cite our work if you use our dataset.
@article{tan2025venusfactory,
title={VenusFactory: A Unified Platform for Protein Engineering Data Retrieval and Language Model Fine-Tuning},
author={Tan, Yang and Liu, Chen and Gao, Jingyuan and Wu, Banghao and Li, Mingchen and Wang, Ruilin and Zhang, Lingrong and… See the full description on the dataset page: https://huggingface.co/datasets/AI4Protein/eSOL_AlphaFold2_PDB.SortingSignal_AlphaFold2_PDB
SortingSignal_AlphaFold2_PDB Dataset
Description: Protein sorting signal prediction.
Number of labels: 9
Problem Type: multi_label_classification
Columns:
aa_seq: protein amino acid sequence
Github
VenusFactory: A Unified Platform for Protein Engineering Data Retrieval and Language Model Fine-Tuning
https://github.com/ai4protein/VenusFactory
Citation
Please cite our work if you use our dataset.
@article{tan2025venusfactory,
title={VenusFactory: A Unified… See the full description on the dataset page: https://huggingface.co/datasets/AI4Protein/SortingSignal_AlphaFold2_PDB.alphafold2-fold-switching-sensitivity
AlphaFold2 Fold-Switching Sensitivity Analysis
Systematic RMSD analysis of 183 proteins from the DeepMind fold-switching benchmark, comparing AlphaFold2 predictions under baseline vs decoy input conditions, with a random perturbation control to establish a noise baseline.
Dataset Summary
This dataset contains per-protein RMSD values comparing AlphaFold2 predictions to experimentally determined structures under three conditions:
Baseline vs Experimental — standard… See the full description on the dataset page: https://huggingface.co/datasets/bjornshomelab/alphafold2-fold-switching-sensitivity.DeepLoc2Multi_AlphaFold2_PDB
DeepLoc2Multi_AlphaFold2_PDB Dataset
Github
VenusFactory: A Unified Platform for Protein Engineering Data Retrieval and Language Model Fine-Tuning
https://github.com/ai4protein/VenusFactory
Citation
Please cite our work if you use our dataset.
@article{tan2025venusfactory,
title={VenusFactory: A Unified Platform for Protein Engineering Data Retrieval and Language Model Fine-Tuning},
author={Tan, Yang and Liu, Chen and Gao, Jingyuan and Wu, Banghao and Li… See the full description on the dataset page: https://huggingface.co/datasets/AI4Protein/DeepLoc2Multi_AlphaFold2_PDB.DeepET_Topt_AlphaFold2
DeepET_Topt Dataset
Description: protein optimum temperature.
Number of labels: 1
Problem Type: regression
Columns:
aa_seq: protein amino acid sequence
ss8_seq: DSSP 8 secondary structure sequence
foldseek_seq: foldseek 20 3di structural sequence
ss3_seq: DSSP 3 secondary structure sequence
Github
VenusFactory: A Unified Platform for Protein Engineering Data Retrieval and Language Model Fine-Tuning
https://github.com/ai4protein/VenusFactory
Citation
Please… See the full description on the dataset page: https://huggingface.co/datasets/AI4Protein/DeepET_Topt_AlphaFold2.VenusX_Motif_AlphaFold2_PDBVenusVaccine_TumorBinary_AlphaFold2VenusX_Evo_AlphaFold2_PDBVenusVaccine_BacteriaBinary_AlphaFold2VenusX_BindI_AlphaFold2_PDBVenusX_Act_AlphaFold2_PDB
