Migration of MDL/ISIS sample database to ACD/Spectrus DB Platform

Customer

Pharma company

Goal

Migrate obsolete samples database to a recent system

Description

To preserve production operations and historical data, the no-longer supported MDL/ISIS Base database had to be migrated to a Windows 10 compatible software. ACD/Spectrus platform has been chosen as destination software because of its capability to store and search chemical structures and spectra to enrich the knowledge collected around a specific sample. To successfully accomplish the task three steps have been taken:

  • Proof of Concept to determine export feasibility with special attention to molecular structure conversion issues
  • Reverse engineering approach to derive the underlying data model.
  • Data migration from source model to target data model with Extract-Transform-Load (ETL) KNIME workflow (Link to KNIME session)
  • Configuration of screen and entry forms in the target software to improve user experience and data integrity.

Team

 

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