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Molecular dynamics by NMR data analysis

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Commit [r14854] Maximize Restore History

Fixes for the metal position optimisation test data.

The RDCs and PCSs were 3 times too large!

Authored by: bugman 2011-10-12

Browse code at this revision

Parent: [r14853]

Child: [r14855]

changed	/1.3/test_suite/shared_data/align_data/metal_pos_opt/generate.py
changed	/1.3/test_suite/shared_data/align_data/metal_pos_opt/missing_pcs_0
changed	/1.3/test_suite/shared_data/align_data/metal_pos_opt/missing_pcs_1
changed	/1.3/test_suite/shared_data/align_data/metal_pos_opt/missing_pcs_2
changed	/1.3/test_suite/shared_data/align_data/metal_pos_opt/missing_pcs_3
changed	/1.3/test_suite/shared_data/align_data/metal_pos_opt/missing_rdc_0
changed	/1.3/test_suite/shared_data/align_data/metal_pos_opt/missing_rdc_2
changed	/1.3/test_suite/shared_data/align_data/metal_pos_opt/missing_rdc_3

/1.3/test_suite/shared_data/align_data/metal_pos_opt/generate.py Diff Switch to side-by-side view

/1.3/test_suite/shared_data/align_data/metal_pos_opt/missing_pcs_0 Diff Switch to side-by-side view

/1.3/test_suite/shared_data/align_data/metal_pos_opt/missing_pcs_1 Diff Switch to side-by-side view

/1.3/test_suite/shared_data/align_data/metal_pos_opt/missing_pcs_2 Diff Switch to side-by-side view

/1.3/test_suite/shared_data/align_data/metal_pos_opt/missing_pcs_3 Diff Switch to side-by-side view

/1.3/test_suite/shared_data/align_data/metal_pos_opt/missing_rdc_0 Diff Switch to side-by-side view

/1.3/test_suite/shared_data/align_data/metal_pos_opt/missing_rdc_2 Diff Switch to side-by-side view

/1.3/test_suite/shared_data/align_data/metal_pos_opt/missing_rdc_3 Diff Switch to side-by-side view