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Molecular dynamics by NMR data analysis

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Commit [r22080] Maximize Restore History

Added the truncated data for creating a system test to catch bug #21562.

This bug (https://gna.org/bugs/?21562) was reported by Dhanas Muthu (https://gna.org/users/dhanas)
and is the failure of the NOE analysis when spectra are replicated.

This consists of the Sparky peak lists attached to the bug report and the modified 2AT7 PDB file.
The data has been truncated to only include residues :12, :13, and :14.

Authored by: bugman 2014-01-31

Browse code at this revision

Parent: [r22079]

Child: [r22081]

added	/trunk/test_suite/shared_data/peak_lists/bug_21562
added	/trunk/test_suite/shared_data/peak_lists/bug_21562/n_np4_hs_ph65_02mm_noe1.list
added	/trunk/test_suite/shared_data/peak_lists/bug_21562/n_np4_hs_ph65_02mm_noe2.list
added	/trunk/test_suite/shared_data/peak_lists/bug_21562/y_np4_hs_ph65_02mm_noe1.list
added	/trunk/test_suite/shared_data/peak_lists/bug_21562/y_np4_hs_ph65_02mm_noe2.list
added	/trunk/test_suite/shared_data/structures/2AT7_fmf.pdb

/trunk/test_suite/shared_data/peak_lists/bug_21562

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Molecular dynamics by NMR data analysis

Commit [r22080] Maximize Restore History

/trunk/test_suite/shared_data/peak_lists/bug_21562

/trunk/test_suite/shared_data/peak_lists/bug_21562/n_np4_hs_ph65_02mm_noe1.list Diff Switch to side-by-side view

/trunk/test_suite/shared_data/peak_lists/bug_21562/n_np4_hs_ph65_02mm_noe2.list Diff Switch to side-by-side view

/trunk/test_suite/shared_data/peak_lists/bug_21562/y_np4_hs_ph65_02mm_noe1.list Diff Switch to side-by-side view

/trunk/test_suite/shared_data/peak_lists/bug_21562/y_np4_hs_ph65_02mm_noe2.list Diff Switch to side-by-side view

/trunk/test_suite/shared_data/structures/2AT7_fmf.pdb Diff Switch to side-by-side view