A brief introduction to chemical reaction optimization
From the start of a synthetic chemist's training, experiments are conducted based on recipes
from textbooks and manuscripts that achieve clean reaction outcomes, allowing the scientist …
from textbooks and manuscripts that achieve clean reaction outcomes, allowing the scientist …
Self-driving laboratories for chemistry and materials science
Self-driving laboratories (SDLs) promise an accelerated application of the scientific method.
Through the automation of experimental workflows, along with autonomous experimental …
Through the automation of experimental workflows, along with autonomous experimental …
Autonomous chemical experiments: Challenges and perspectives on establishing a self-driving lab
Conspectus We must accelerate the pace at which we make technological advancements to
address climate change and disease risks worldwide. This swifter pace of discovery requires …
address climate change and disease risks worldwide. This swifter pace of discovery requires …
Nanoparticle synthesis assisted by machine learning
Many properties of nanoparticles are governed by their shape, size, polydispersity and
surface chemistry. To apply nanoparticles in chemical sensing, medical diagnostics …
surface chemistry. To apply nanoparticles in chemical sensing, medical diagnostics …
A multi-objective active learning platform and web app for reaction optimization
We report the development of an open-source experimental design via Bayesian
optimization platform for multi-objective reaction optimization. Using high-throughput …
optimization platform for multi-objective reaction optimization. Using high-throughput …
Toward autonomous laboratories: Convergence of artificial intelligence and experimental automation
The ever-increasing demand for novel materials with superior properties inspires retrofitting
traditional research paradigms in the era of artificial intelligence and automation. An …
traditional research paradigms in the era of artificial intelligence and automation. An …
From characterization to discovery: artificial intelligence, machine learning and high-throughput experiments for heterogeneous catalyst design
J Benavides-Hernández, F Dumeignil - ACS Catalysis, 2024 - ACS Publications
This review paper delves into synergistic integration of artificial intelligence (AI) and
machine learning (ML) with high-throughput experimentation (HTE) in the field of …
machine learning (ML) with high-throughput experimentation (HTE) in the field of …
Data-science driven autonomous process optimization
Autonomous process optimization involves the human intervention-free exploration of a
range process parameters to improve responses such as product yield and selectivity …
range process parameters to improve responses such as product yield and selectivity …
Closed-loop transfer enables artificial intelligence to yield chemical knowledge
Artificial intelligence-guided closed-loop experimentation has emerged as a promising
method for optimization of objective functions,, but the substantial potential of this …
method for optimization of objective functions,, but the substantial potential of this …
Self‐driving platform for metal nanoparticle synthesis: combining microfluidics and machine learning
Many applications of inorganic nanoparticles (NPs), including photocatalysis, photovoltaics,
chemical and biochemical sensing, and theranostics, are governed by NP optical properties …
chemical and biochemical sensing, and theranostics, are governed by NP optical properties …