paramagpy.dataparse

Functions

read_pcs(fileName)

Read pseudo contact shift values from file.

read_rdc(fileName)

Read residual dipolar coupling values from file.

read_pre(fileName)

Read paramagnetic relaxation enhancement values from file.

read_ccr(fileName)

Read cross-correlated relaxation values from file.

Classes

DataContainer(*args, **kwargs)

A dictionary-like container for storing PCS, RDC, PRE and CCR data Has an additional attribute ‘dtype’ to define datatype