A water playground for peptide re-assembly from fibrils to plates DOI Creative Commons
Simone Adorinni, Marina Kurbasic, Ana M. García

и другие.

Journal of Materials Chemistry B, Год журнала: 2024, Номер unknown

Опубликована: Янв. 1, 2024

Short-peptide amyloid assembly and disassembly play crucial roles in various research fields, which range from addressing pathologies that lack therapeutic solutions to the development of innovative soft (bio)materials. Hydrogels short peptides typically show thermo-reversible gel-to-sol transition, whereby fibrils disassemble upon heating, re-assemble cooling down room temperature (rt). Despite ongoing intense studies this area, majority focus on peptide-peptide interaction neglect structuring role water peptide supramolecular behavior. This study describes an unprotected tetrapeptide gelator forms highly stable which, re-organize into plates persist rt. All-atom molecular dynamics (MD) simulations experimental methods reveal as a key player thermodynamics accompany irreversible morphological advance our understanding structures.

Язык: Английский

Aromatic short peptide architectonics: Assembly and engineering DOI
Kai Tao, Haoran Wu, Lihi Adler‐Abramovich

и другие.

Progress in Materials Science, Год журнала: 2024, Номер 142, С. 101240 - 101240

Опубликована: Янв. 7, 2024

Язык: Английский

Процитировано

14

Directed discovery of high-loading nanoaggregates enabled by drug-matched oligo-peptide excipients DOI
Naxhije Berisha,

Atena Farahpour,

Maithreyi Ramakrishnan

и другие.

Chem, Год журнала: 2025, Номер unknown, С. 102404 - 102404

Опубликована: Янв. 1, 2025

Язык: Английский

Процитировано

1

A new design and computational survey on RGD biofunctionalized RADA16-I self-assembling peptide for tissue engineering applications DOI

Nasrin Jafary Aryan,

Havva Mehralitabar,

Sakineh Kazemi Noureini

и другие.

International Journal of Biological Macromolecules, Год журнала: 2025, Номер unknown, С. 142071 - 142071

Опубликована: Март 1, 2025

Язык: Английский

Процитировано

1

Deep Learning Empowers the Discovery of Self‐Assembling Peptides with Over 10 Trillion Sequences DOI Creative Commons
Jiaqi Wang, Zihan Liu, Shuang Zhao

и другие.

Advanced Science, Год журнала: 2023, Номер 10(31)

Опубликована: Сен. 25, 2023

Self-assembling of peptides is essential for a variety biological and medical applications. However, it challenging to investigate the self-assembling properties within complete sequence space due enormous quantities. Here, demonstrated that transformer-based deep learning model effective in predicting aggregation propensity (AP) peptide systems, even decapeptide mixed-pentapeptide systems with over 10 trillion Based on predicted AP values, not only laws designing are derived, but transferability relation among APs pentapeptides, decapeptides, mixed pentapeptides also revealed, leading discoveries by concatenating or mixing, as consolidated experiments. This approach enables speedy, accurate, thorough search design oligopeptides, advancing science inspiring new

Язык: Английский

Процитировано

18

Sequestration within peptide coacervates improves the fluorescence intensity, kinetics, and limits of detection of dye-based DNA biosensors DOI Creative Commons
Christopher M. Green, Deborah Sementa, Divita Mathur

и другие.

Communications Chemistry, Год журнала: 2024, Номер 7(1)

Опубликована: Фев. 29, 2024

Peptide-based liquid-liquid phase separated domains, or coacervates, are a biomaterial gaining new interest due to their exciting potential in fields ranging from biosensing drug delivery. In this study, we demonstrate that coacervates provide simple and biocompatible medium improve nucleic acid biosensors through the sequestration of both biosensor target strands within coacervate, thereby increasing local concentration. Using well-established polyarginine (R

Язык: Английский

Процитировано

9

Oxidation‐Responsive Supramolecular Hydrogel Based on a Simple Fmoc‐Cysteine Derivative Capable of Showing Autonomous Gel–Sol–Gel Transitions DOI Creative Commons

Yuki Shintani,

Hiroshi Katagiri, Masato Ikeda

и другие.

Advanced Functional Materials, Год журнала: 2024, Номер 34(25)

Опубликована: Фев. 12, 2024

Abstract Aqueous soft matter, including supramolecular hydrogels capable of exhibiting stimuli–responsive macroscopic phase transitions, has attracted increasing attention for the exploration functional materials. However, investigation that undergo autonomous and multiple transitions (e.g., gel–sol–gel, sol–gel–sol) in response to surrounding environment without repeated additions stimuli remained largely unexplored. In this study, oxidation‐responsive gel–sol–gel fabricated via self‐assembly a simple fluorenylmethyloxycarbonyl (Fmoc)‐protected, benzylated cysteine ( Fmoc‐C Bzl ) is presented. During evaluation oxidation process , it revealed oxidized products, two diastereomeric sulfoxides ‐( R )‐O S ), exhibit significantly different propensities under aqueous conditions. It may be noteworthy chirality sulfoxide overlooked not effectively used modulate supramolecular, self‐assembled nanostructures. The difference kinetics self‐assembly/disassembly as well co‐assembly will contribute transitions.

Язык: Английский

Процитировано

7

Reshaping the discovery of self-assembling peptides with generative AI guided by hybrid deep learning DOI
Marko Njirjak, Lucija Žužić, Marko Babić

и другие.

Nature Machine Intelligence, Год журнала: 2024, Номер unknown

Опубликована: Ноя. 19, 2024

Язык: Английский

Процитировано

7

Therapeutic supramolecular polymers: Designs and applications DOI Creative Commons
Han Wang, Jason C. Mills, Boran Sun

и другие.

Progress in Polymer Science, Год журнала: 2023, Номер 148, С. 101769 - 101769

Опубликована: Дек. 2, 2023

Язык: Английский

Процитировано

17

Salt-induced Fmoc-tripeptide supramolecular hydrogels: a combined experimental and computational study of the self-assembly DOI Creative Commons
Miryam Criado‐Gonzalez, Mario Iván Peñas, Florent Barbault

и другие.

Nanoscale, Год журнала: 2024, Номер 16(20), С. 9887 - 9898

Опубликована: Янв. 1, 2024

Delving into the mechanism behind molecular interactions at atomic level of short-sequence peptides plays a key role in development nanomaterials with specific structure–property–function relationships from bottom-up perspective.

Язык: Английский

Процитировано

5

Investigation of Peptides for Molecular Recognition of C-Reactive Protein–Theoretical and Experimental Studies DOI Creative Commons
Katarzyna Szot-Karpińska,

Patryk Kudła,

Urszula Orzeł

и другие.

Analytical Chemistry, Год журнала: 2023, Номер 95(38), С. 14475 - 14483

Опубликована: Сен. 11, 2023

We investigate the interactions between C-reactive protein (CRP) and new CRP-binding peptide materials using experimental (biological physicochemical) methods with support of theoretical simulations (computational modeling analysis). Three specific peptides (P2, P3, P9) derived from an M13 bacteriophage have been identified phage-display technology. The binding efficiency exposed on phages toward CRP was demonstrated via biological methods. Fibers selected phages/peptides interact differently due to different compositions amino acid sequences peptides, which confirmed by transmission electron microscopy. Numerical studies consistently showed that P3 is best binder. A combination demonstrates identifying binder can be performed simply, cheaply, fast. Such approach has not reported previously for screening a trend in science where calculations replace or laborious techniques. Finally, binder─the peptide─was used recognition silicate-modified indium tin oxide-coated glass electrodes. obtained electrodes exhibit wide range operation (1.0-100 μg mL-1) detection limit (LOD = 3σ/S) 0.34 mL-1. Moreover, dissociation constant Kd 4.2 ± 0.144 mL-1 (35 1.2 nM) evaluated change current. selectivity electrode presence three interfering proteins. These results prove presented potential candidate as receptor CRP, antibodies.

Язык: Английский

Процитировано

12