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C. Orengo

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Open access Sep 2026

Employing AlphaFold and TED to Explore the Structural Impacts of Stress-associated Mutations in Rice

Plants have evolved adaptive mechanisms to handle environmental stress. However, Genome-Wide-Association-Studies have identified genetic variations associated with stress resistance, yet their structural and functional impacts remain poorly understood. This limits our ability to develop more resilient crops....

Fatima Shahid, Neeladri Sen, C. Orengo et al. · 0 citations
Open access Sep 2026

ContrasTED: contrastive domain embeddings for scalable remote homology classification

Protein structure prediction has expanded structural databases to hundreds of millions of domains. Classifying these domains into homologous superfamilies reveals evolutionary and functional relationships that can persist despite low sequence similarity. As the size of structural databases continues to grow, homology c...

David Miller, Nicola Bordin, Janusan Jeyananthan et al. · 0 citations
Open access Aug 2026

Structural plasticity drives convergent evolution and functional diversification of GNAT polyamine acetyltransferases.

A characterization of a large subset of PAAT enzymes, including their likely oligomeric states, functional site properties, and experimental functions is presented, including their likely oligomeric states, functional site properties, and experimental functions.

J. Roca-Martínez, Hazel N. Leiva Martel, Jialin Yin et al. · 0 citations
Open access Jul 2026

Expanding all-α-helical protein space through rational computational design

De novo protein design is advancing rapidly1,2. This is being driven by AI to generate protein backbones, sequences, and structural models3–7. As a result, de novo designed proteins are becoming larger and more complex8–10, and increasingly explore new protein structures11,12. By contrast, natural proteins have evolved...

K. I. Albanese, Joel J. Chubb, L. Gutierrez-Rus et al. · 0 citations

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