Self-driving laboratories for chemistry and materials science

G Tom, SP Schmid, SG Baird, Y Cao, K Darvish… - Chemical …, 2024 - ACS Publications
Self-driving laboratories (SDLs) promise an accelerated application of the scientific method.
Through the automation of experimental workflows, along with autonomous experimental …

The hitchhiker's guide to flow chemistry∥

MB Plutschack, B Pieber, K Gilmore… - Chemical …, 2017 - ACS Publications
Flow chemistry involves the use of channels or tubing to conduct a reaction in a continuous
stream rather than in a flask. Flow equipment provides chemists with unique control over …

Automating drug discovery

G Schneider - Nature reviews drug discovery, 2018 - nature.com
Small-molecule drug discovery can be viewed as a challenging multidimensional problem in
which various characteristics of compounds—including efficacy, pharmacokinetics and …

Automation and computer-assisted planning for chemical synthesis

Y Shen, JE Borowski, MA Hardy, R Sarpong… - Nature Reviews …, 2021 - nature.com
The molecules of today—the medicines that cure diseases, the agrochemicals that protect
our crops, the materials that make life convenient—are becoming increasingly sophisticated …

Optimizing chemical reactions with deep reinforcement learning

Z Zhou, X Li, RN Zare - ACS central science, 2017 - ACS Publications
Deep reinforcement learning was employed to optimize chemical reactions. Our model
iteratively records the results of a chemical reaction and chooses new experimental …

Next-generation experimentation with self-driving laboratories

F Häse, LM Roch, A Aspuru-Guzik - Trends in Chemistry, 2019 - cell.com
The ever-growing demand for advanced functional materials requires disruption of
conventional approaches to experimentation and acceleration of the discovery process …

[HTML][HTML] Machine learning meets continuous flow chemistry: Automated optimization towards the Pareto front of multiple objectives

AM Schweidtmann, AD Clayton, N Holmes… - Chemical Engineering …, 2018 - Elsevier
Automated development of chemical processes requires access to sophisticated algorithms
for multi-objective optimization, since single-objective optimization fails to identify the trade …

The past, present and potential for microfluidic reactor technology in chemical synthesis

KS Elvira, XC i Solvas, RCR Wootton, AJ Demello - Nature chemistry, 2013 - nature.com
The past two decades have seen far-reaching progress in the development of microfluidic
systems for use in the chemical and biological sciences. Here we assess the utility of …

Why microfluidics? Merits and trends in chemical synthesis

Y Liu, X Jiang - Lab on a Chip, 2017 - pubs.rsc.org
The intrinsic limitations of conventional batch synthesis have hindered its applications in
both solving classical problems and exploiting new frontiers. Microfluidic technology offers a …

Organic synthesis: march of the machines

SV Ley, DE Fitzpatrick, RJ Ingham… - Angewandte Chemie …, 2015 - Wiley Online Library
Organic synthesis is changing; in a world where budgets are constrained and the
environmental impacts of practice are scrutinized, it is increasingly recognized that the …