1D NMR simulation (macromolecules/amorphous solids)¶

The following examples are the NMR spectrum simulation of macromolecules and amorphous materials for the following methods:

Bloch decay method (BlochDecaySpectrum),
Central transition selective Bloch decay method (BlochDecayCTSpectrum).

For NMR simulation of amorphous solids, we also show examples of simulating spectrum using user-defined model or using commonly accepted models such as Czjzek or extended Czjzek distribution.

Protein GB1, ¹³C and ¹⁵N (I=1/2)

Amorphous material, ²⁹Si (I=1/2)

Amorphous material, ²⁷Al (I=5/2)

Czjzek distribution (Shielding and Quadrupolar)

Extended Czjzek distribution (Shielding and Quadrupolar)