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protein folding

2,452 papers

#protein folding Open access Sep 2026

From sequences and structures to fitness, folding and function: challenges in the age of AI

Deep-learning models have transformed our ability to predict the phenotypic effects of sequence perturbations. Protein language models (pLMs) score the evolutionary propensity of any amino-acid substitution, emerging as fast and accurate predictors of fitness changes. Inverse-folding (IF) models add structural informat...

Ezequiel A. Galpern, Charles W. J. Pugh, Mafalda Dias et al. · 0 citations
#protein folding Open access Sep 2026

Machine learning-guided drug repurposing for targeting PDK1 in breast cancer treatment

The phosphoinositide 3-kinase (PI3K)/3-phosphoinositide-dependent protein kinase-1 (PDK1)/protein kinase B (AKT) signaling axis is dysregulated in breast cancer progression and therapeutic resistance. In this study, an integrated computational workflow was developed to prioritize FDA-approved drugs as potential PDK1-ta...

Srinivas Ganjipete, Bandral Sunil Kumar, Basavana Gowda Hosur Dinesh et al. · 0 citations
#protein folding Open access Sep 2026

СТАТЬЯ 3. МАСШТАБНЫЙ ДУАЛИЗМ ИНВАРИАНТА 6.25 нм — 6.25 мкм: ОТ МЕТАФОРЫ ФИГУР ХЛАДНИ К ДИНАМИЧЕСКОЙ СВЕТОЗВУКОВОЙ ГОЛОГРАММЕ ПАНХОНДРИОМА / ARTICLE 3. THE DUAL SCALE INVARIANT OF 6.25 nm — 6.25 μm: FROM CHLADNI FIGURES METAPHOR TO THE DYNAMIC LIGHT-SOUND HOLOGRAM OF PANCHONDRIOME

НА РУССКОМ (RU): Аннотация. Завершающая работа трилогии PANCHONDRIOME 3.5 переходит от макроскопических метафор к квантово-полевому базису живой материи — голограмме Фрёлиха, выводя пространственный инвариант морфогенеза dL = 6.25 мкм на стыке ТГц Бозе-конденсации (0.24 ТГц) и EZ-воды Поллака. Представлено опровержение...

Konstantin D. Pisarenko · 0 citations
#protein folding Dataset Open access Sep 2026

Western-blot source data, reagent inventories, and figure source data supporting: Aqueous Hellenia speciosa rhizome extract attenuates hepatic injury in high-fat diet/streptozotocin-induced diabetic rats

This dataset provides the source-data files underlying the figures and the reagent inventories of the study "Aqueous Hellenia speciosa rhizome extract attenuates hepatic injury in high-fat diet/streptozotocin-induced diabetic rats" (Filfilan & Elbeeh). Included: (1) Figure 6 per-field morphometric source values (steato...

Mohamed Elbeeh, Wissam Filfilan · 0 citations
#protein folding Open access Sep 2026

Effects of Buriti (Mauritia flexuosa) Oil and Pulp Supplementation on Lipid Profile and Hepatic Markers in Healthy Mice

Background: Amazonian biodiversity includes plant resources with potential metabolic activity. Buriti (Mauritia flexuosa) contains monounsaturated fatty acids, carotenoids, and phenolic compounds. Objectives: This study evaluated treatment-associated biochemical and morphological differences after buriti oil or lyophil...

Luis Carlos Gonçalves · 0 citations
#protein folding Open access Sep 2026

Reproducibility materials for similarity-stratified retraining sensitivity in fixed protein-sequence benchmarks

Final reproducibility package aligned with the train-fold-only PCA development analysis, within-benchmark antifungal confirmation, external TAPE remote-homology validation, Supplementary Tables S1-S6 and current Figure 1-3 source data.

renxingye110 · 0 citations
#protein folding Open access Sep 2026

The enigmatic loss of hyper-reactivity toward GSSG in structural protein cysteines during evolution: the case of transferrin superfamily.

Structural analysis and fluorometric evidence indicate that, over evolutionary time, these proteins lost the ability to properly bind GSSG, thereby abolishing hyper-reactivity, and pKa values of their cysteines are scattered across a wide range, resulting in a hierarchical reactivity toward GSSG that may be crucial for...

Unknown authors · 0 citations
#protein folding Open access Sep 2026

Molecular characterization of the orphan toxin-immunity pair Rhs2-SciX from Salmonella Typhimurium.

This work probes the structure and function of the orphan toxin-immunity pair Rhs2-SciX, demonstrates the biochemical diversity of Salmonella T6SS effectors, and highlights the conserved T6SS toxicity strategy of binding EF-Tu.

N. Cobo, S. Goyal, David E. Davidson et al. · 0 citations
#protein folding Open access Sep 2026

Probing the native state of a two-state folding protein by high pressure NMR spectroscopy.

Intramolecular distances existing between the sheets that define the β-barrel fold of BsCspB have been shown to respond nonuniformly to increasing hydrostatic pressure, suggesting that the three-dimensional structure of native BsCspB is modified such that β-strands depart from each other.

Frédéric Berner, Michael Kovermann · 0 citations
#protein folding Open access Sep 2026

Natural selection shapes the evolution of the metabolome in Saccharomyces cerevisiae

Abstract Metabolite abundances represent the ultimate functional outputs of cellular processes and provide a direct link between genotype and phenotype. While the evolutionary dynamics of mRNA and protein abundances have been extensively studied, the evolutionary forces shaping metabolite abundances remain largely unex...

Hai-Chao Li, Hao-Xuan Liu · 0 citations
#protein folding Sep 2026

PPARα Activation Attenuates Right Ventricular Hypertrophy by Regulating Myocardial Glucose and Lipid Metabolism in High-Altitude Pulmonary Hypertension In Vivo and In Vitro.

It is demonstrated that PPARα exerts a protective effect against RVH, at least in part, by promoting fatty acid oxidation through upregulation of its downstream target proteins CPT-1 and acyl-CoA oxidase 1.

Xiao-Ying Zhang, Jia-Jia Wu, Yu-Chan Zhang et al. · 0 citations
#protein folding Open access Sep 2026

The perfect carbon TOCSY (iPE TOCSY) facilitates assignment of large biomolecules

Side chain assignments are essential for in-depth characterization of proteins. We present here two refined TOCSY experiments based on the use of a variant of “perfect echo” to partially suppress the negative effects arising from homonuclear 13C couplings in the indirect dimension: The iPE-(H)CCH-TOCSY for correlating...

Arnelle Löbbert, Aditya Pokharna, Philipp Rössler et al. · 0 citations

From tech blogs

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Google DeepMind Blog Sep 30, 2026

Introducing SynthID Bio

Proof of concept for watermarking AI-generated proteins while preserving biological function.

MIT News · Artificial Intelligence Aug 27, 2026

Looking beyond natural sequences

A new machine-learning framework aims to improve the success rate of computational protein design while moving away from results that reproduce sequences found in nature.

Google DeepMind Blog Nov 25, 2025

AlphaFold: Five years of impact

Explore how AlphaFold has accelerated science and fueled a global wave of biological discovery.

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