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 …

Atlas: a brain for self-driving laboratories

R Hickman, M Sim, S Pablo-García, I Woolhouse… - 2023 - chemrxiv.org
Self-driving laboratories (SDLs) are next-generation research and development platforms for
closed-loop, autonomous experimentation that combine ideas from artificial intelligence …

Dynamic observation policies in observation cost-sensitive reinforcement learning

C Bellinger, M Crowley, I Tamblyn - arXiv preprint arXiv:2307.02620, 2023 - arxiv.org
Reinforcement learning (RL) has been shown to learn sophisticated control policies for
complex tasks including games, robotics, heating and cooling systems and text generation …

Chemistry3D: Robotic Interaction Benchmark for Chemistry Experiments

S Li, Y Huang, C Guo, T Wu, J Zhang, L Zhang… - arXiv preprint arXiv …, 2024 - arxiv.org
The advent of simulation engines has revolutionized learning and operational efficiency for
robots, offering cost-effective and swift pipelines. However, the lack of a universal simulation …

[PDF][PDF] Worlds Of Observation: Building more realistic environments for

RJ Hardwick - methods, 2023 - umbralcalc.github.io
In designing automated control algorithms of practical importance to the real world it's
common to find that only partial observations of the system state are possible. One needs …

[PDF][PDF] Dynamic programming with incomplete information to overcome navigational uncertainty in POMDPs

C Beeler, X Li, C Bellinger, M Crowley, M Fraser… - assets.pubpub.org
Using a generalizable novel nautical navigation environment, we show how dynamic
programming can be used when only incomplete information about a partially observed …

Demonstrating ChemGymRL: An Interactive Framework for Reinforcement Learning for Digital Chemistry

C Beeler, SG Subramanian, K Sprague… - AI for Accelerated … - openreview.net
This tutorial describes a simulated laboratory for making use of reinforcement learning (RL)
for chemical discovery. A key advantage of the simulated environment is that it enables RL …