Welcome to mrsimulator’s documentation!

The package mrsimulator contains key functionality and tools needed for simulating one-dimensional nuclear magnetic resonance (NMR) lineshapes using Python. The package is currently under development. Version 0.1.0 supports simulation of single spin \(I=\frac{1}{2}\) nuclei static, magic angle spinning (MAS), and variable angle spinning (VSA) lineshapes.

Indices and tables

See also

Examples