OCTOPUS: operation control system for task optimization and job parallelization via a user-optimal scheduler DOI Creative Commons

Hyuk Jun Yoo,

Kwan‐Young Lee, Dong-Hun Kim

и другие.

Nature Communications, Год журнала: 2024, Номер 15(1)

Опубликована: Ноя. 8, 2024

The material acceleration platform, empowered by robotics and artificial intelligence, is a transformative approach for expediting discovery processes across diverse domains. However, the development of an operating system platform faces challenges in simultaneously managing experiments from multiple users. Specifically, when it utilized users, overlapping experimental modules or devices can lead to inefficiencies both resource utilization safety hazards. To overcome these challenges, we present operation control namely, OCTOPUS, which acronym task optimization job parallelization via user-optimal scheduler. OCTOPUS streamlines experiment scheduling optimizes through integrating its interface node, master node module nodes. Leveraging process modularization network protocol, ensures homogeneity, scalability, versatility platform. In addition, embodies Job techniques mitigate delays hazards within realistic operational environments, while closed-packing schedule algorithm efficiently executes jobs with minimal waste. Copilot developed promote reusability potential users their own sets lab resources, substantially simplifies code generation customization GPT recommendations client feedback. This work offers solution encountered accessed thereby will facilitate widespread adoption processes.

Язык: Английский

Recent advances in synthetic organic electrochemistry using flow systems DOI Creative Commons
David Cantillo

Current Opinion in Electrochemistry, Год журнала: 2024, Номер 44, С. 101459 - 101459

Опубликована: Фев. 6, 2024

The recent resurgence of electrochemical methods in organic synthesis has also boosted the interest use flow electrolysis cells. Flow electrolyzers are essential tools for scale up processes due to their high electrode surface area reactor volume ratio, which only depends on interelectrode gap regardless size. Recent literature topic reveals that cell a very common tool lab provide gram amounts material, often enabling lower voltages and decrease supporting electrolyte needed reaction. Scale-up multi-100 g kilogram been demonstrated both using numbering sizing strategies.

Язык: Английский

Процитировано

7

Trends and Challenges in Electrifying Technical Organic Synthesis DOI Creative Commons
Philipp Röse,

Paul Neugebauer,

Siddharth Tamang

и другие.

Chemie Ingenieur Technik, Год журнала: 2025, Номер unknown

Опубликована: Март 18, 2025

Abstract Organic electrosynthesis is a potential enabler for the energy and resource transition in chemical industry as it offers sustainable alternative to homogeneous or heterogeneous processes producing fine commodity chemicals. It utilizes electricity instead of hazardous reagents and, thus, also allows reducing product's carbon footprint waste production. enables dynamic operation safe due galvanostatic process control. Electro‐organic are not yet widespread. Engineering tools have been tailored electro‐organic processes, more quantitative model‐based insight needed. Extensive adoption requires efforts regarding electrode material performance stability, scalable reactor design, digitization. Addressing these issues interdisciplinary collaboration, particularly between chemists engineers, accelerate implementation with high efficiency economic feasibility.

Язык: Английский

Процитировано

1

Accelerating materials research with a comprehensive data management tool: a case study on an electrochemical laboratory DOI Creative Commons
Nico C. Röttcher, Gun Deniz Akkoc, S.M. Finger

и другие.

Journal of Materials Chemistry A, Год журнала: 2024, Номер 12(7), С. 3933 - 3942

Опубликована: Янв. 1, 2024

Introduction of an SQL and Python-based tool for managing research data from acquisition to publication. The method enables FAIR-compatible management, minimizes user interaction, provides customizability diverse domains.

Язык: Английский

Процитировано

4

An Automated Electrochemical Flow Platform to Accelerate Library Synthesis and Reaction Optimization DOI Creative Commons

Eduardo Rial-Rodríguez,

Jason D. Williams, David Cantillo

и другие.

Опубликована: Апрель 9, 2024

Automated batch and flow reactors are well-established for high throughput experimentation in both thermal chemistry photochemistry. However, the development of automated electrochemical platforms is hindered by cell miniaturization challenges difficulties designing effective single-pass systems. In order to address these issues, we have designed implemented a new, slug-based platform. This platform was successfully demonstrated C-N cross-couplings E3 ligase binders with diverse amines (44 examples), which were subsequently transferred continuous-flow mode confirmation isolation. To further validate versatility platform, Design Experiments (DoE) optimization performed an unsuccessful library target. process, fully resulted remarkable 5-fold increase reaction yield.

Язык: Английский

Процитировано

4

Python for Electrochemistry: A Free and All-In-One Toolset DOI Creative Commons
Weiran Zheng

ECS Advances, Год журнала: 2023, Номер 2(4), С. 040502 - 040502

Опубликована: Окт. 2, 2023

Python, an open-source, interpreted programming language, has emerged as a transformative force within the scientific community, captivating researchers with its rich ecosystem of packages and syntax that prioritizes readability simplicity. In rapidly evolving field electrochemistry, where analysis complex data sets, custom routines, theoretical simulations are indispensable, Python’s capabilities have garnered significant attention. This review serves general introduction to utilization Python in focusing on beginners who new concepts.

Язык: Английский

Процитировано

7

Automated Optimization of the Synthesis of Alkyl Arenesulfonates in an Undivided Electrochemical Flow Cell DOI Creative Commons
Maximilian M. Hielscher, Johannes Schneider, Alexander H. J. Lohmann

и другие.

ChemElectroChem, Год журнала: 2024, Номер unknown

Опубликована: Авг. 19, 2024

Abstract The necessary separation of anodic and cathodic compartments in the electrochemical multicomponent synthesis alkyl arenesulfonates batch was overcome by transfer this reaction an undivided flow cell. yield increased from initial 23 % to 67 optimization using Design Experiments (DoE). experiments were carried out automated experimental electrolysis setup controlled automation software LABS ( Laboratory Automation Batch Scheduling ), open‐source that allows plan conduct with arbitrary, freely selectable setup. turned be stable provides reproducible results. In total, 6 examples are demonstrated isolated yields up 81 %. addition, robust scalability a 10‐fold scale‐up.

Язык: Английский

Процитировано

2

A Universal Framework for Fast, Flexible and Fun(ctional) Autonomous Laboratories DOI Creative Commons
Nicholas A. Jose, Peace Adesina, Kévin Ballu

и другие.

Опубликована: Апрель 23, 2024

The construction of autonomous chemical laboratories is complex, laborious, and expensive. It imperative to develop highly usable, flexible, powerful development framework unify efforts. Current platforms have high adoption barriers, whether through their price adoption, complexity implement, or limited implementation on diverse hardware software systems. Furthermore, there are no studies date which examine the practical usability current with state-of-the-art scientific studies. In this work we engineer a new, flexible laboratory automation platform (FLAB) resolve these issues. With unique, user-centric agile approach, eight different experimental studies, represent broad spectrum activities in integration artificial intelligence. By beginning generalized, modular architecture Python, each study created generalized feature that evolved platform’s utility ease use. Such features include advanced methods for synchronous processing, data manipulation user-interface rapid prototyping. Ultimately, yields simpler, more accessible toolset creation laboratories.

Язык: Английский

Процитировано

1

Automation in Electrifying Flow Organic Synthesis DOI Creative Commons
Tomas Hardwick, Nisar Ahmed

Опубликована: Авг. 6, 2024

Organic electrochemical synthesis may be combined with continuous flow and automation technology. Here, the authors highlight benefits if such chemical engineering approaches along technology software directions taking organic chemistry into future.

Язык: Английский

Процитировано

1

Automation in Electrifying Flow Organic Synthesis DOI Creative Commons
Tomas Hardwick, Nisar Ahmed

Tetrahedron Chem, Год журнала: 2024, Номер unknown, С. 100105 - 100105

Опубликована: Окт. 1, 2024

Язык: Английский

Процитировано

1

Where is chemistry's moon? Highlights from the 1st conference for the Center of the Transformation of Chemistry (CTC) at Ringberg Castle 2023 DOI Creative Commons
Matthew B. Plutschack, Peter H. Seeberger

Green Chemistry, Год журнала: 2024, Номер 26(13), С. 7443 - 7455

Опубликована: Янв. 1, 2024

The CTC-Conference at Ringberg brought scientists together to discuss their research and brainstorm a "moon-shot" program align efforts, enable rapid discoveries, move towards sustainable circular economy.

Язык: Английский

Процитировано

0