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CDD Vault Update (April 2019): Structure LookUp; Populate Synonyms; Inventory Current Location

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April 13, 2019

Not only are April showers busy bringing May flowers, but we have it on good authority that the CDD Development team is super busy bringing customers tons of exciting new features. We hope you enjoy the new features included in this 1st April 2019 release.

(SPOILER ALERT: Be sure to audit this CDD Vault Updates blog and witness the exciting new features still to come!)

  • "1" list icon for CDD Vault ELN Blog Posts

    CDD Vault Marvin Structure Editor Now Provides Powerful Look-Up Function

    The Marvin Structure Editor has always been an integral part of the CDD Vault platform.  In both the CDD Vault registration system and the CDD Vault ELN, Marvin provides an interactive mechanism for drawing chemical structures and/or reactions for querying, registering or inserting into ELN entries.

    Marvin now has the ability to look up structures based on a variety of input values (including CDD Vault Molecule IDs, CDD Vault Synonyms, IUPAC Names, Common Names and CAS Numbers).  Just click the blue CDD Vault insert icon and type the value you wish to look up. Marvin will now render your value as a chemical structure.

    Note: The repository of Common Names and CAS Numbers that are available for look-up will be expanded in subsequent releases.

     

    Screen grab of Marvin Structure Editor in CDD Vault ELN

    Marvin Structure Editor now supports structure look-up based on a variety of input values

  • "2" list icon for CDD Vault ELN Blog Posts

    Populate Synonym Values Directly from the Interactive “Create New Molecule” Workflow

    Users who manually register new Molecules can now populate Synonym values directly on the initial data entry form.

    Screen grab of molecule registration entry form in CDD Vault ELN

    Now populate synonym values directly in initial data entry form when manually registering new molecules

  • "3" list icon for CDD Vault ELN Blog Posts

    Inventory Current Location

    The value displayed in the Inventory Current Location field will now be the most recent value populated for a Location in a debit row. Users who wish to have blank Current Locations will have to populate some value (“blank”, “No Location”, etc) and map to the Location Inventory field when inserting a debit row.

     

    Screen grab of Inventory Current Location screen in CDD Vault ELN

    Inventory Current Location field value now the most recent value populated for a Location in a debit row

This blog is authored by members of the CDD Vault community. CDD Vault is a hosted drug discovery informatics platform that securely manages both private and external biological and chemical data. It provides core functionality including chemical registrationstructure activity relationshipchemical inventory, and electronic lab notebook capabilities.

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WE'RE ALWAYS HERE TO HELP!

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Know that CDD Support is here to help you reference CDD Vault in your talks, posters, or other presentations. Contact us if you want assistance with:

  1. Documenting algorithms used within CDD Vault;
  2. Creating screen shots;
  3. Proofreading slides; or
  4. Any other tasks.

Whatever you need, we're always ready to help!

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