Identifying Performance Advantaged Biobased Chemicals Utilizing Bioprivileged Molecules

Project: Research project

Project Details

Description

The contributions of the Broadbelt group will focus on identifying bioprivileged molecules using in silico methods. We have developed a computational platform to map chemical space given a variety of different starting molecules and operators that encode typical catalytic reactions. The overall approach relies on a computational framework developed previously in the Broadbelt group for automated generation of reaction networks.
StatusFinished
Effective start/end date10/1/189/30/22

Funding

  • Iowa State University (401-20-25A AMD 3 // DE-EE0008492/003)
  • Department of Energy (401-20-25A AMD 3 // DE-EE0008492/003)

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