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Blog

Postdoc Position in Cheminformatics and Computational Metabolomics

5 Dec,2017 stein

A postdoc position is available in my research group at Friedrich-Schiller-University Jena, Germany. Open Positions: Postdoc: We are looking for …

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Compliance with minimum information guidelines in public metabolomics repositories

26 Sep,2017 stein

Rachel Spicer in my group in Cambridge has published an article in Nature Scientific Data on the compliance with minimum …

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Opinion Piece on the Future of Metabolomics in ELIXIR

6 Sep,2017 stein

Leading metabolomics researchers across Europe have co-authored an opinion piece in F1000 Research about “The Future of Metabolomics in ELIXIR”. …

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Great talk about CDK 2.0 capabilities by John May at ACS meeting in Washington

24 Aug,2017 stein

John May gave a greatĀ talk about the capabilities of the 2.0 release of the Chemistry Development Kit (CDK) in a …

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Article: Automatic Assembly of Species Metabolomes

15 Aug,2017 stein

Together with our collaborator Mark Viant in Birmingham, Robert Hall in Wageningen and Laura Reed at the University of Alabama, …

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Review: Navigating freely-available software tools for metabolomics analysis.

14 Aug,2017 stein

PhD student Rachel Spicer, last woman standing in my research group in Cambridge, has just published her review on navigating …

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Steinbeck group joins Michael Stifel Center for Data-Drive and Simulation Science

10 Aug,2017 stein

The Michael-Stifel CenterĀ in Jena promotes interdisciplinary research and teaching in the field of data-driven and simulation-based sciences. For us, this …

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Next EMBO Course for Computational Metabolomics

10 Aug,2017 stein

We have been co-organising the EMBO Course for Computational Metabolomics in Cambridge for the last four years. The next course …

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Postdoc and phd positions

9 Aug,2017 stein

Postdoc position and phd positions are available in our group at Jena University, Germany. The successful candidates will work in …

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Steinbeck group joins de.NBI as associate member

9 Aug,2017 stein

It is our pleasure to join the German Network for Bioinformatics (de.NBI) as an associate member.

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News

  • STOUT V2.0: SMILES to IUPAC name conversion using transformer models
  • COCONUT 2.0: a comprehensive overhaul and curation ofthe collection of open natural products database
  • Advancements in hand-drawn chemical structure recognition through an enhanced DECIMER architecture
  • An automated calculation pipeline for differential pair interaction energies with molecular force fields using the Tinker Molecular Modeling Package
  • NMRShiftDB turns 20 years old

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