Cheminformatics and Computational Metabolomics

Cheminformatics and Computational Metabolomics

Friedrich-Schiller-University, Jena, Germany

  • Research
    • Overview
    • Software
    • Data
    • Funding
    • Collaborations
    • Deep Learning for chemical information mining
  • Teaching
  • Infrastructure
  • Web-services
  • Members
    • Current Members
    • Alumni
  • Publications
  • News
  • Jobs

Blog

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

14 Aug,2017 steinLeave a comment

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 steinLeave a comment

The Michael-Stifel Center 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 steinLeave a comment

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 steinLeave a comment

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 steinLeave a comment

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

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News

  • Cheminformatics Microservice: unifying access to open cheminformatics toolkits
  • DECIMER.ai: an open platform for automated optical chemical structure identification, segmentation and recognition in scientific publications
  • MAW: the reproducible Metabolome Annotation Workflow for untargeted tandem mass spectrometry
  • Notes on molecular fragmentation and parameter settings for a dissipative particle dynamics study of a C10E4/water mixture with lamellar bilayer formation
  • Open data and algorithms for open science in AI-driven molecular informatics

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