spectrochempy-hypercomplex

Hypercomplex / quaternion support plugin for SpectroChemPy.

Provides quaternion-based dataset types, quaternion-aware processing operations, and utilities for working with hypercomplex NMR data.

Installation

pip install spectrochempy[hypercomplex]

Usage

import spectrochempy as scp

# Enable hypercomplex support.
dataset = scp.read_topspin("path/to/2rr")
dataset.set_quaternion()

This plugin requires SpectroChemPy.

Development

pip install -e .
pip install -e plugins/spectrochempy-hypercomplex
cd plugins/spectrochempy-hypercomplex
python -m pytest tests/