"Parallel Iterative Reaction Path Optimization in ab initio Quantum Mechanical/Molecular Mechanical Modeling of Enzyme Reaction"

Journal Article (Academic article)

Duke Authors

Cited Authors

  • Liu, H; Lu, Z; Cisneros, GA; Yang, W

Published Date

  • 2004

Published In

  • J. Chem. Phys.

Volume / Issue

  • 121 /

Start / End Page

  • 697 - 706

PubMed ID

  • 15260596