Commit | Date | |
---|---|---|
[r8810]
by
bugman
Modified the NH bond length to be 1.041 Angstrom in the system test script. This is from Ottiger, M. and Bax A., J. Am. Chem. Soc. (1998), 120, 12334-12341. |
2009-02-17 09:56:07 | Tree |
[r8809]
by
bugman
Modified the NH bond length to be 1.041 Angstrom. This is from Ottiger, M. and Bax A., J. Am. Chem. Soc. (1998), 120, 12334-12341. |
2009-02-17 09:08:28 | Tree |
2009-02-16 13:22:13 | Tree | |
[r8807]
by
bugman
Modified the print out to remove the broken Eigenvalue sum and add the Saupe order matrix. |
2009-02-16 10:45:40 | Tree |
[r8806]
by
bugman
The RDC data is now formatted for Pales, to check the synthetic test model and relax. |
2009-02-16 10:34:05 | Tree |
[r8805]
by
bugman
Modified how the generic peak intensity file is detected. The change is that if no other formats are detected, relax falls back to the generic format. |
2009-02-15 18:05:15 | Tree |
[r8804]
by
bugman
When finding attached atoms, the radius of atoms assumed to be bonded has been increased to 2 Angstrom. |
2009-02-15 13:54:29 | Tree |
[r8803]
by
bugman
Some fixes for the test_read_pdb_internal1() and test_read_pdb_scientific1() system tests. |
2009-02-15 13:45:10 | Tree |
2009-02-15 13:44:38 | Tree | |
2009-02-15 11:51:13 | Tree |