InstructPro2: Natural Language and Biological Grounding Guided De Novo Protein Design
Read the original on arXiv Machine Learning →The Flow has not summarised this story yet — read it at arXiv Machine Learning.
The Flow has not summarised this story yet — read it at arXiv Machine Learning.
The ability to generate proteins with desired functions is a central goal of computational biology. Although natural language can express diverse design objectives, existing protein generation methods...
The paper introduces Prompteina, an all‑atom protein structure generation model that accepts natural‑language descriptions of desired structural and functional properties, similar to text‑to‑image systems. It is trained on a large paired dataset of 1.8 million protein structures and over 50 million captions, and fine‑tuned from the Proteina‑Complexa model to align residues with textual cues. Prompteina outperforms existing baselines on most structural metrics, improves binder design performance, and experimentally validates nine new binders for the GM2A target.
ProtModernBERT is a modernized BERT-style protein language model that reduces training cost by incorporating architectural refinements, achieving performance comparable to larger models while cutting pre‑training FLOPs by 80‑90%. The authors benchmark ProtModernBERT against ProtBert, Amplify, and ESM2 on supervised structural tasks and a zero‑shot functional benchmark, showing it matches or closely tracks Amplify‑120M and ProtBert. Their cluster‑based validation and random‑init experiments reveal that modern architectural components provide stronger inductive biases than parameter count in low‑compute regimes.
arXiv:2505. 20346v3 Announce Type: replace-cross Abstract: Function-guided protein design is a crucial task with significant applications in drug discovery and enzyme engineering.
Large protein language models provide a powerful framework for learning sequence-function relationships and guiding experimental design. However, architectural improvements are underexplored, especial...
SymFold introduces a symmetric dual‑path architecture that combines protein language models (PLMs) and multimodal protein language models (MPLMs) to iteratively guide protein sequence generation for inverse folding. By leveraging pretrained sequence evolution knowledge from PLMs and structural knowledge from MPLMs, the method improves upon the traditional serial pipeline where structure encoders produce coarse sequences refined by PLMs. Experiments on standard inverse‑folding benchmarks show state‑of‑the‑art performance, and ablation studies confirm the effectiveness of the symmetric design.