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ChEMBL Plug-in for StarDrop

Wednesday, 19 June 2019 15:23

ChEMBL is probably the foremost manually curated database of bioactive molecules with drug-like properties. It brings together chemical, bioactivity and genomic data to aid the translation of genomic information into effective new drugs. This script enables you to search ChEMBL directly from StarDrop, returning the data pre-formatted and ready to use for tasks such as:

  • Identifying potential off-target activities for your compounds
  • Understanding SAR around your compounds or targets
  • Building QSAR models to make predictions for new compounds

The installer file and instructions for how to install and use the script are provided in the following pages...

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Enamine Plug-in for StarDrop

Friday, 31 August 2018 09:06

This script enables you to search the EnamineStore, a database of their commercially available compounds. This will return details about the availability of specific compounds and find those that are structurally similar to your most interesting hits and leads or contain relevant substructures.

The installer file and instructions for how to install and use the script are provided in the following pages...

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ICSYNTH light Plug-in for StarDrop

Sunday, 17 March 2019 11:23

This script enables you to access ICSYNTH light to evaluate possible synthetic pathways for new molecules designed in StarDrop’s interactive designer or Nova module. ICSYNTH light uses a transform-based approach to generate synthesis pathways for target molecules, even if these are novel and/or unpublished. This script will display the possible synthetic pathways in a web browser.

To learn more about this plug-in watch our joint Webinar with InfoChem.

The installer files are provided in the following pages...

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