Tag: chemoinformatics

Er zijn 5 datasets met het label chemoinformatics:

• ChemBank

  • 55 views
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  About ChemBank is a public, web-based informatics environment created by the Broad Institute's Chemical Biology Program and funded in large part by the National Cancer Institute's...
• Blue Obelisk Data Repository (BODR)

  • 49 views
  • Geen open licentie
  Description "Another core Blue Obelisk project is the development of a shared data repository. This repository lists many important chemoinformatics data such as elemental properties,...
• DrugBank

  • 91 views
  • Geen open licentie
  About The DrugBank database is a unique bioinformatics and cheminformatics resource that combines detailed drug (i.e. chemical, pharmacological and pharmaceutical) data with comprehensive...
• NMRShiftDB

  • 55 views
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  Description NMRShiftDB is a NMR database (web database) for organic structures and their nuclear magnetic resonance (nmr) spectra. It allows for spectrum prediction (13C, 1H and other...
• Chemical Structure Repository

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  • zip

  • 13 views
  • Geen open licentie
  Description Chemical Structures was initiated in June 2006. It aims to provide a set of organic structures, which includes 3D coordinates, InChi code, molecular weight, melting point,...