A Text-guided Protein Design Framework

Fuente: arXiv
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Main Authors: Liu, Shengchao, Li, Yanjing, Li, Zhuoxinran, Gitter, Anthony, Zhu, Yutao, Lu, Jiarui, Xu, Zhao, Nie, Weili, Ramanathan, Arvind, Xiao, Chaowei, Tang, Jian, Guo, Hongyu, Anandkumar, Anima
Format: Preprint
Published: 2023
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author Liu, Shengchao
Li, Yanjing
Li, Zhuoxinran
Gitter, Anthony
Zhu, Yutao
Lu, Jiarui
Xu, Zhao
Nie, Weili
Ramanathan, Arvind
Xiao, Chaowei
Tang, Jian
Guo, Hongyu
Anandkumar, Anima
author_facet Liu, Shengchao
Li, Yanjing
Li, Zhuoxinran
Gitter, Anthony
Zhu, Yutao
Lu, Jiarui
Xu, Zhao
Nie, Weili
Ramanathan, Arvind
Xiao, Chaowei
Tang, Jian
Guo, Hongyu
Anandkumar, Anima
contents Current AI-assisted protein design mainly utilizes protein sequential and structural information. Meanwhile, there exists tremendous knowledge curated by humans in the text format describing proteins' high-level functionalities. Yet, whether the incorporation of such text data can help protein design tasks has not been explored. To bridge this gap, we propose ProteinDT, a multi-modal framework that leverages textual descriptions for protein design. ProteinDT consists of three subsequent steps: ProteinCLAP which aligns the representation of two modalities, a facilitator that generates the protein representation from the text modality, and a decoder that creates the protein sequences from the representation. To train ProteinDT, we construct a large dataset, SwissProtCLAP, with 441K text and protein pairs. We quantitatively verify the effectiveness of ProteinDT on three challenging tasks: (1) over 90% accuracy for text-guided protein generation; (2) best hit ratio on 12 zero-shot text-guided protein editing tasks; (3) superior performance on four out of six protein property prediction benchmarks.
format Preprint
id arxiv_https___arxiv_org_abs_2302_04611
institution arXiv
publishDate 2023
record_format arxiv
spellingShingle A Text-guided Protein Design Framework
Liu, Shengchao
Li, Yanjing
Li, Zhuoxinran
Gitter, Anthony
Zhu, Yutao
Lu, Jiarui
Xu, Zhao
Nie, Weili
Ramanathan, Arvind
Xiao, Chaowei
Tang, Jian
Guo, Hongyu
Anandkumar, Anima
Machine Learning
Artificial Intelligence
Quantitative Methods
Current AI-assisted protein design mainly utilizes protein sequential and structural information. Meanwhile, there exists tremendous knowledge curated by humans in the text format describing proteins' high-level functionalities. Yet, whether the incorporation of such text data can help protein design tasks has not been explored. To bridge this gap, we propose ProteinDT, a multi-modal framework that leverages textual descriptions for protein design. ProteinDT consists of three subsequent steps: ProteinCLAP which aligns the representation of two modalities, a facilitator that generates the protein representation from the text modality, and a decoder that creates the protein sequences from the representation. To train ProteinDT, we construct a large dataset, SwissProtCLAP, with 441K text and protein pairs. We quantitatively verify the effectiveness of ProteinDT on three challenging tasks: (1) over 90% accuracy for text-guided protein generation; (2) best hit ratio on 12 zero-shot text-guided protein editing tasks; (3) superior performance on four out of six protein property prediction benchmarks.
title A Text-guided Protein Design Framework
topic Machine Learning
Artificial Intelligence
Quantitative Methods
url https://arxiv.org/abs/2302.04611