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Biological and Medicinal Chemistry

Working Paper

Combining Generative Artificial Intelligence and On-Chip Synthesis for De Novo Drug Design

Francesca Grisoni, Berend Huisman, Alexander Button, Michael Moret, Kenneth Atz, Daniel Merk, Gisbert Schneider

Version 1 posted 30 December 2020

724

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1

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Theoretical and Computational Chemistry

Working Paper

Strategies and Software for Machine Learning Accelerated Discovery in Transition Metal Chemistry

Aditya Nandy, Chenru Duan, Jon Paul Janet, Stefan Gugler, Heather Kulik

Version 1 posted 21 August 2018

1,103

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1

Citations

Analytical Chemistry

Working Paper

Automated Stirring Device for Continuous Stirring While Sampling in Liquid Chromatography Systems

Omer Markovitch, Jim Ottelé, Obe Veldman, Sijbren Otto

Version 1 posted 26 June 2020

485

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Analytical Chemistry

Working Paper

Online HPLC Analysis of Buchwald-Hartwig Aminations from Within an Inert Environment

Thomas C. Malig, Lars P. E. Yunker, Sebastian Steiner, Jason E. Hein

Version 1 posted 18 August 2020

527

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Theoretical and Computational Chemistry

Working Paper

Inferring Experimental Procedures from Text-Based Representations of Chemical Reactions

Alain C. Vaucher, Philippe Schwaller, Joppe Geluykens, Vishnu H Nair, Anna Iuliano, Teodoro Laino

Version 1 posted 21 October 2020

752

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1

Citations

Chemical Engineering and Industrial Chemistry

Working Paper

An Integrated Console for Capsule-Based, Fully Automated Organic Synthesis

Tuo Jiang, Samuele Bordi, Angus E. McMillan, Kuang-Yen Chen, Fumito Saito, Paula Nichols, Benedikt Wanner, Jeffrey Bode

Version 1 posted 25 March 2019

2,904

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6

Citations

Analytical Chemistry

Working Paper

A 3D-printed Microfluidic System for Automated and Near Real-time Quantitation of Biofilm-induced indole

Giraso Kabandana, Curtis G. Jones, Sahra Khan Sharifi, Chengpeng Chen

Version 1 posted 20 December 2019

399

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Organic Chemistry

Working Paper

Automated Fast-Flow Synthesis of Antisense Phosphorodiamidate Morpholino Oligomers

Chengxi Li, Alexander J. Callahan, Mark D. Simon, Kyle A. Totaro, Alexander J. Mijalis, Nina Hartrampf, Carly K. Schissel, Ming Zhou, Hong Zong, Gunnar J. Hanson, Andrei Loas, Nicola L. B. Pohl, Bradley L. Pentelute

Version 1 posted 22 July 2020

1,004

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Theoretical and Computational Chemistry

Working Paper

An automated method for graph-based chemical space exploration and transition state finding.

Pablo Ramos-Sánchez, Jeremy Harvey, Jose Gámez

Version 2 posted 02 June 2022

877

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Analytical Chemistry

Working Paper

A Simple and Flexible Infusion Platform for Automated Native Mass Spectrometry Analysis

Stephanie Thibert, Carter Bracken, Daniel Orton, Bryson Gibbons, Mowei Zhou

Version 1 posted 18 May 2023

271

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Refine Search

89 results in Automation in Keywords: Automation

Combining Generative Artificial Intelligence and On-Chip Synthesis for De Novo Drug Design

Strategies and Software for Machine Learning Accelerated Discovery in Transition Metal Chemistry

Automated Stirring Device for Continuous Stirring While Sampling in Liquid Chromatography Systems

Online HPLC Analysis of Buchwald-Hartwig Aminations from Within an Inert Environment

Inferring Experimental Procedures from Text-Based Representations of Chemical Reactions

An Integrated Console for Capsule-Based, Fully Automated Organic Synthesis

A 3D-printed Microfluidic System for Automated and Near Real-time Quantitation of Biofilm-induced indole

Automated Fast-Flow Synthesis of Antisense Phosphorodiamidate Morpholino Oligomers

An automated method for graph-based chemical space exploration and transition state finding.

A Simple and Flexible Infusion Platform for Automated Native Mass Spectrometry Analysis

89 results in Keywords: Automation