license: cc-by-nc-4.0
dataset_info:
features:
- name: accession
dtype: string
- name: name
dtype: string
- name: Full Name
dtype: string
- name: taxon
dtype: string
- name: sequence
dtype: string
- name: function
dtype: string
- name: AlphaFoldDB
dtype: string
splits:
- name: train
num_bytes: 168911398
num_examples: 248315
- name: test
num_bytes: 3470418
num_examples: 4203
- name: validation
num_bytes: 3443875
num_examples: 4172
download_size: 134650306
dataset_size: 175825691
configs:
- config_name: default
data_files:
- split: train
path: data/train-*
- split: test
path: data/test-*
- split: validation
path: data/validation-*
Dataset Card for Prot2Text-Data
Page: Prot2Text
Paper: https://arxiv.org/abs/2307.14367
Github: https://github.com/hadi-abdine/Prot2Text
Authors: Hadi Abdine(1), Michail Chatzianastasis(1), Costas Bouyioukos(2, 3), Michalis Vazirgiannis(1)
(1)DaSciM, LIX, École Polytechnique, Institut Polytechnique de Paris, France.
(2)Epigenetics and Cell Fate, CNRS UMR7216, Université Paris Cité, Paris, France.
(3)Bioinformatics Research Laboratory, Department of Biological Sciences, University of Cyprus, Nicosia, Cyprus.
Prot2Text paper is published in AAAI 2024. Preliminary versions of the paper were accepted as a spotlight at DGM4H@NeurIPS 2023 and AI4Science@NeurIPS 2023.
Dataset Description
This dataset is designed for training the Prot2Text framework. It contains information for 256,690 proteins and is comprised of three modalities:
- Protein sequence (amino acid sequence).
- Protein structure using its AlphaFold accession ID.
- Textual description of the protein
The dataset is built from the SwissProt database, a component of UniProtKB Release 2022_04.
Dataset Structure
Data Fields:
- name: (string) codename of the protein.
- Full Name: (string) Full name of the protein.
- sequence: (string) Amino acid sequence of the protein.
- AlphaFoldDB: (string) Accession ID of the protein in AlphaFold database.
- taxon: (string) Species information for the protein.
- function: (string) Textual description of the protein.
Data Splits:
The dataset is split into training, validation, and test sets with a maximum sequence similarity threshold of 40% within each set using the CD-HIT clustering algorithm.
- Train: 248,315 proteins
- Validation: 4,172 proteins
- Test: 4,203 proteins
Considerations for Using the Data
The dataset is built from a single source (SwissProt). Consider incorporating data from other sources to increase diversity. The textual descriptions may contain biases present in the original database. Be mindful of these biases when using the data for downstream tasks.
License
We are releasing this dataset under the terms of CC-BY-NC-4.0.
Citation
Please cite this dataset and the original sources if you use this dataset in your work
@inproceedings{abdine2024prot2text,
title={Prot2Text: Multimodal Protein's Function Generation with GNNs and Transformers},
author={Abdine, Hadi and Chatzianastasis, Michail and Bouyioukos, Costas and Vazirgiannis, Michalis},
booktitle={Proceedings of the AAAI Conference on Artificial Intelligence},
volume={38},
pages={10757--10765},
year={2024}
}