Enabling technologies for the future of chemical synthesis

DE Fitzpatrick, C Battilocchio, SV Ley - ACS central science, 2016 - ACS Publications
Technology is evolving at breakneck pace, changing the way we communicate, travel, find
out information, and live our lives. Yet chemistry as a science has been slower to adapt to …

A novel internet-based reaction monitoring, control and autonomous self-optimization platform for chemical synthesis

DE Fitzpatrick, C Battilocchio… - Organic Process Research …, 2016 - ACS Publications
We have developed a modular software system that enables researchers to monitor and
control chemical reactions via the Internet, using any device from any location in the world. It …

A new world for chemical synthesis?

SV Ley, Y Chen, DE Fitzpatrick, O May - Chimia, 2019 - chimia.ch
This perspective seeks to provide an overarching vision of the current state of chemical
synthesis methodology using machinery as enabling tools. It highlights current capabilities …

Design and implementation of English reading examination system based on WEB platform

L Guo, Z Zhao, L Bai, J Lv, X Zhao - International Journal of …, 2017 - learntechlib.org
For the self-assessment and practice-based improvement of students' English reading level,
this paper designed an English reading test system based on the WEB platform, which will …

Synthesize in a Smart Way: A Brief Introduction to Intelligence and Automation in Organic Synthesis

DZ Lin, G Fang, K Liao - Machine Learning in Molecular Sciences, 2023 - Springer
In this chapter, we will give a brief introduction to intelligence and automation in organic
synthesis. The chapter includes five main sections. In the first section, selected examples of …

In silico rationalisation of selectivity and reactivity in Pd-catalysed C–H activation reactions

L Cao, M Kabeshov, SV Ley… - Beilstein Journal of …, 2020 - beilstein-journals.org
A computational approach has been developed to automatically generate and analyse the
structures of the intermediates of palladium-catalysed carbon–hydrogen (C–H) activation …

[图书][B] Machine Learning in Molecular Sciences

C Qu, H Liu - 2023 - Springer
In July 2022, DeepMind announced that they have predicted and released structures for
nearly all catalogued proteins known to science, with over 200 million structures, using their …