UW-DNMR v0.3.0 (alpha)

UW-DNMR (Un-Windowed Dynamic NMR; pronounced “You Dee En Em Arr”) is a Python implementation of the core features of WinDNMR by Hans Reich. The long-term goal is to replicate the features of WinDNMR and to provide a useful open-source application for Mac and Linux as well as Windows.

UNDER CONSTRUCTION

Contents:

• Installation
• Features
• User Guide
  • Changing the Plot View
  • Calculation Type Selection
  • The Multiplet Menu: non-QM Solutions
    • Conventions Used
    • First-Order Multiplet
    • AB and AB₂
    • ABX
    • ABX₃
    • AA’XX’
    • AA’BB’
  • The ABC… Menu: QM Simulation of Second-Order Spin Systems
  • The DNMR Menu: Simulated Lineshapes for Exchanging Nuclei
    • 2-spin
    • AB Coupled
• Feedback
• Acknowledgements