WorkflowHub

9 items tagged with 'Cheminformatics'.

People (9)

Teams: Not specified

Organizations: Not specified

https://orcid.org/0000-0002-4479-0636

Expertise: Cheminformatics, Metabolomics

Tools: Galaxy, R, Mass spectrometry

Bundit Boonyarit

Teams: BAID Team

Organizations: Vidyasirimedhi Institute of Science and Technology

https://orcid.org/0000-0003-4425-2608

Expertise: Bioinformatics, Cheminformatics, Machine Learning, Proteomics, Molecular Modelling, Biomolecular Dynamics Simulations

Tools: Machine Learning, Biochemistry and protein analysis, Computational and theoretical biology

I'm Bundit, a current Ph.D. candidate in Information Science and Technology at the Natural Language Processing and Representation Learning Lab (NRL), Vidyasirimedhi Institute of Science and Technology (VISTEC), Thailand. I received a B.Sc. degree in Chemistry from Prince of Songkla University, Thailand and an M.S. degree in Biochemistry from Kasetsart University, Thailand.

My interdisciplinary research bridges the disciplines of Biochemistry, Molecular Biology, Chemistry, Pharmaceutical Sciences, ...

DINESH Ravindra Raju

Teams: Not specified

Organizations: Not specified

https://orcid.org/0000-0003-0657-1560

Expertise: Bioinformatics, Cheminformatics

Computation Biologist @UT Southwestern

Teams: RECETOX SpecDatRI, RECETOX, usegalaxy-eu, ELIXIR Metabolomics, Intergalactic Workflow Commission (IWC)

Organizations: Masaryk University, RECETOX

https://orcid.org/0000-0001-6744-996X

Expertise: Bioinformatics, Cheminformatics, Metabolomics, Python, R, Software Engineering, Workflows

Tools: Metabolomics, Python, R, Workflows, Mass spectrometry, Chromatography

Kateřina Storchmannová

Teams: Chemical Data Lab

Organizations: Department of Physical Chemistry, Faculty of Science, Palacký University Olomouc

https://orcid.org/0000-0003-0285-6948

Expertise: Cheminformatics

Tools: Jupyter notebook, Python, R, Workflows

Teams: de.NBI Cloud

Organizations: de.NBI Cloud, German Network for Bioinformatics Infrastructure – de.NBI

https://orcid.org/0000-0002-6540-6875

Expertise: Bioinformatics, Cheminformatics, Software Engineering, Metabolomics, Lipidomics

Jeanette Reinshagen

Teams: EU-Openscreen

Organizations: Fraunhofer Institute for Translational Medicine and Pharmacology ITMP

https://orcid.org/0000-0002-8080-9170

Expertise: Bioinformatics, Cheminformatics, Machine Learning

Tools: Workflows

Teams: EU-Openscreen, OME

Organizations: Fraunhofer Institute for Translational Medicine and Pharmacology ITMP

https://orcid.org/0000-0002-1740-8390

Expertise: Cheminformatics, Bioinformatics

Tools: R, Python, Workflows

Jean-Loup Faulon

Teams: IBISBA Workflows

Organizations: INRAe

https://orcid.org/0000-0003-4274-2953

Expertise: Synthetic Biology, Computer Aided Design, Scientific workflow developement, Retrosynthesis, Systems Biology, Bioinformatics, Cheminformatics

Tools: Machine Learning, Galaxy

Research Director @ INRAe

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