Accelerating the Discovery of Abiotic Vesicles with AI-Guided Automated Experimentation DOI
M. C. Ekosso, Hao Liu,

Avery Glagovich

et al.

Langmuir, Journal Year: 2024, Volume and Issue: 41(1), P. 858 - 867

Published: Dec. 30, 2024

The first protocells are speculated to have arisen from the self-assembly of simple abiotic carboxylic acids, alcohols, and other amphiphiles into vesicles. To study complex process vesicle formation, we combined laboratory automation with AI-guided experimentation accelerate discovery specific compositions underlying principles governing formation. Using a low-cost commercial liquid handling robot, automated experimental procedures, enabling high-throughput testing various reaction conditions for mixtures seven (7) amphiphiles. Multitemplate multiscale template matching (MMTM) was used automate confocal microscopy image analysis, us quantify formation without tedious manual counting. results were create Gaussian surrogate model, then active learning iteratively direct experiments reduce model uncertainty. Mixtures containing primarily trimethyl decylammonium decylsulfate in equal amounts formed vesicles at submillimolar critical concentrations, more than 20% glycerol monodecanoate prevented forming even high total amphiphile concentrations.

Language: Английский

Role of the human-in-the-loop in emerging self-driving laboratories for heterogeneous catalysis DOI
Christoph Scheurer, Karsten Reuter

Nature Catalysis, Journal Year: 2025, Volume and Issue: 8(1), P. 13 - 19

Published: Jan. 29, 2025

Language: Английский

Citations

4

Engineering a Sustainable Future: Harnessing Automation, Robotics, and Artificial Intelligence with Self-Driving Laboratories DOI
Sina Sadeghi, Richard B. Canty,

Nikolai Mukhin

et al.

ACS Sustainable Chemistry & Engineering, Journal Year: 2024, Volume and Issue: 12(34), P. 12695 - 12707

Published: Aug. 6, 2024

The accelerating depletion of natural resources undoubtedly demands a radical reevaluation research practices addressing the escalating climate crisis. From traditional approaches to modern-day advancements, integration automation and artificial intelligence (AI)-guided decision-making has emerged as transformative route in shaping new methodologies. Harnessing robotics high-throughput alongside intelligent experimental design, self-driving laboratories (SDLs) offer an innovative solution expedite chemical/materials timelines while significantly reducing carbon footprint scientific endeavors, which could be utilized not only generate green materials but also make process itself more sustainable. In this Perspective, we examine potential SDLs driving sustainability forward through case studies discovery optimization, thereby paving way for greener efficient future. While hold immense promise, discuss challenges that persist their development deployment, necessitating holistic approach both design implementation.

Language: Английский

Citations

5

Decoding the Broadband Emission of 2D Pb‐Sn Halide Perovskites through High‐Throughput Exploration DOI
Elham Foadian, Jonghee Yang, Sumner B. Harris

et al.

Advanced Functional Materials, Journal Year: 2024, Volume and Issue: 34(52)

Published: Aug. 24, 2024

Abstract Unlike single‐component 2D metal halide perovskites (MHPs) exhibiting sharp excitonic photoluminescence (PL), a broadband PL emerges in mixed Pb‐Sn lattices. Two physical models –self‐trapped exciton and defect‐induced Stokes‐shift – are proposed to explain this unconventional phenomenon. However, the explanations provide limited rationalizations without consideration of formidable compositional space, thus, fundamental origin remains elusive. Herein, high‐throughput automated experimental workflow is established systematically explore MHPs, employing PEA (Phenethylammonium) as model cation known work rigid organic spacer. Spectrally, becomes further broadened with rapid 2 PbI 4 phase segregation increasing Pb concentrations during early‐stage crystallization. Counterintuitively, MHPs high exhibit prolonged lifetimes. Hyperspectral microscopy identifies substantial those films, hypothesizing that establishment charge transfer excitons by upon crystallization at high‐Pb compositions results distinctive properties. These indicate two independent mechanisms—defect‐induced Stoke‐shifts segregation—coexist which significantly correlates Pb:Sn ratio, thereby simultaneously contributing emission HPs.

Language: Английский

Citations

5

Autonomous laboratories for accelerated materials discovery: a community survey and practical insights DOI Creative Commons
Linda Hung,

Joyce A. Yager,

Danielle R. Monteverde

et al.

Digital Discovery, Journal Year: 2024, Volume and Issue: 3(7), P. 1273 - 1279

Published: Jan. 1, 2024

We share the results of a survey on automation and autonomy in materials science labs, which highlight variety researcher challenges motivations. also propose framework for levels laboratory from L0 to L5.

Language: Английский

Citations

4

Physics-driven discovery and bandgap engineering of hybrid perovskites DOI Creative Commons
Sheryl L. Sanchez, Elham Foadian, Maxim Ziatdinov

et al.

Digital Discovery, Journal Year: 2024, Volume and Issue: 3(8), P. 1577 - 1590

Published: Jan. 1, 2024

Discovery of physical models binary compositions using structured Gaussian Process (sGP) with physics-informed mean functions, optimizing materials post-discovery to enhance design and application efficiency.

Language: Английский

Citations

4

Research Trend Analysis in the Field of Self-Driving Labs Using Network Analysis and Topic Modeling DOI Creative Commons

Woojun Jung,

Insung Hwang,

Keuntae Cho

et al.

Systems, Journal Year: 2025, Volume and Issue: 13(4), P. 253 - 253

Published: April 3, 2025

A self-driving lab (SDL) system that automates experimental design, data collection, and analysis using robotics artificial intelligence (AI) technologies. Its significance has grown substantially in recent years. This study analyzes the overall SDL research trends, examines changes specific topics, visualizes relational structure between authors to identify key contributors, extracts major themes from extensive texts highlight essential content. To achieve these objectives, trend analysis, network topic modeling were conducted on 352 papers collected Web of Science 2004 2023. ensure validity results, a correlation matrix was also performed. The results revealed three findings. First, surged since 2019, driven by advancements AI technologies, reflecting heightened activity this field. Second, modern scientific is advancing with focus data-driven approaches, applications, optimization through utilization SDLs. Third, exhibits interdisciplinary convergence, encompassing material optimization, biological processes, predictive algorithms. underscores growing importance SDLs as tool across diverse academic disciplines provides practical insights into sustainable future directions strategic approaches.

Language: Английский

Citations

0

Cross-disciplinary perspectives on the potential for artificial intelligence across chemistry DOI Creative Commons
Austin M. Mroz, Annabel R. Basford, Friedrich Hastedt

et al.

Chemical Society Reviews, Journal Year: 2025, Volume and Issue: unknown

Published: Jan. 1, 2025

We offer ten diverse perspectives exploring the transformative potential of artificial intelligence (AI) in chemistry, highlighting many challenges we face, and offering strategies to address them.

Language: Английский

Citations

0

The evolving role of programming and LLMs in the development of self-driving laboratories DOI Creative Commons
John R. Kitchin

APL Machine Learning, Journal Year: 2025, Volume and Issue: 3(2)

Published: April 30, 2025

Machine learning and automation are transforming scientific research, yet the implementation of self-driving laboratories (SDLs) remains costly complex, it difficult to learn how use these facilities. To address this, we introduce Claude-Light, a lightweight, remotely accessible instrument designed for prototyping algorithms machine workflows. Claude-Light integrates REST API, Raspberry Pi-based control system, an RGB LED with photometer that measures ten spectral outputs, providing controlled but realistic experimental environment. This device enables users explore at multiple levels, from basic programming design learning-driven optimization. We demonstrate application in structured approaches, including traditional scripting, statistical experiments, active methods. In addition, role large language models (LLMs) laboratory automation, highlighting their selection, data extraction, function calling, code generation. While LLMs present new opportunities streamlining they also challenges related reproducibility, security, reliability. discuss strategies mitigate risks while leveraging enhanced efficiency laboratories. provides practical platform students researchers develop skills test before deploying them larger-scale SDLs. By lowering barrier entry this tool facilitates broader adoption AI-driven experimentation fosters innovation autonomous

Language: Английский

Citations

0

Harnessing Synthetic Biology for Sustainable Industrial Innovation: Advances, Challenges, and Future Direction DOI
Emmanuel Chimeh Ezeako, Barine Innocent Nwiloh,

Malachy Chigozie Odo

et al.

Biochemical Engineering Journal, Journal Year: 2025, Volume and Issue: unknown, P. 109777 - 109777

Published: May 1, 2025

Language: Английский

Citations

0

Integration of artificial intelligence and big data in materials science: New paradigms and scientific discoveries DOI

Shuai Yang,

Jianjun Liu,

Fan Jin

et al.

Chinese Science Bulletin (Chinese Version), Journal Year: 2024, Volume and Issue: 69(32), P. 4730 - 4747

Published: July 5, 2024

Language: Английский

Citations

0