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MolPort Plug-in for StarDrop

Wednesday, 07 September 2016 00:00

This script enables you to search the commercial compound vendor lists aggregated by MolPort. This allows searching of compounds from multiple suppliers and returns details about the available compounds.

Take a look at this short movie to see how it works...

To hear the narration, please increase your speaker volume.

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

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GalaXi® Search Tool

Monday, 01 June 2020 12:13

The GalaXi® Search Tool is an add-on to StarDrop which searches the WuXi GalaXi® space for compounds that are similar to a query structure of interest. WuXi's GalaXi® is a chemical space that contains billions of virtual compounds, largely built from WuXi AppTec’s library of novel drug-like scaffolds. Due to a carefully selected building block supply and proven chemistry, the GalaXi® space consists of molecules that can be quickly synthesized on demand. Once you’ve identified compounds of interest, you can easily send the required information to WuXi to request a quote, directly from StarDrop. This tool is analogous to searching the GalaXi® space using BioSolveIT’s InfiniSee software and uses their FTrees technology to quickly search the enormous chemical space. You can find more information on FTrees at www.biosolveit.de/FTrees/.

This script provides an extension to StarDrop that enables you to search GalaXi® directly from StarDrop, returning the data pre-formatted and ready to analyse within StarDrop. For example, you can use this to

  • Investigate the chemical space local to your compound
  • Find structurally novel leads with improved properties or avoid patent-protected space

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Find Similar Compounds in PubChem, ChEMBL or the PDB

Wednesday, 07 September 2016 00:00

This script provides the ability to search PubChem, ChEMBL or the PDB for similar compounds.

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

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