LICENSE
README.md
pyproject.toml
synth_nmr/__init__.py
synth_nmr/chemical_shifts.py
synth_nmr/coupling.py
synth_nmr/data.py
synth_nmr/data_pipeline.py
synth_nmr/j_coupling.py
synth_nmr/nef_io.py
synth_nmr/neural_shifts.py
synth_nmr/nmr.py
synth_nmr/rdc.py
synth_nmr/relaxation.py
synth_nmr/structure_utils.py
synth_nmr/synth_nmr_cli.py
synth_nmr/validation.py
synth_nmr.egg-info/PKG-INFO
synth_nmr.egg-info/SOURCES.txt
synth_nmr.egg-info/dependency_links.txt
synth_nmr.egg-info/entry_points.txt
synth_nmr.egg-info/requires.txt
synth_nmr.egg-info/top_level.txt
tests/test_bmrb_validation.py
tests/test_chemical_shift_physics.py
tests/test_chemical_shift_validation.py
tests/test_chemical_shifts.py
tests/test_chemical_shifts_robustness.py
tests/test_cli.py
tests/test_coupling.py
tests/test_docs_integrity.py
tests/test_integration.py
tests/test_j_coupling.py
tests/test_nef.py
tests/test_nef_io.py
tests/test_nef_parsing.py
tests/test_neural_shifts.py
tests/test_nmr.py
tests/test_rdc.py
tests/test_rdc_robustness.py
tests/test_relaxation.py
tests/test_relaxation_physics.py
tests/test_relaxation_robustness.py
tests/test_structure_utils.py
tests/test_validation.py