Hi,
Could anybody share experiences with exporting data to nmr-relax [1]
from ccpn?
Actually I am looking for the best way to create the sequence input file
[2] which has this format:
# mol_name res_num res_name spin_num spin_name
Ap4Aase_new_3_mol1 1 GLY 1 N
Ap4Aase_new_3_mol1 2 PRO 11 N
Ap4Aase_new_3_mol1 3 LEU 28 N
Ap4Aase_new_3_mol1 4 GLY 51 N
Just as a side which, as both programs are written in python, it would
be great if there is an interface in one or the other way.
Thanks,
Justin
1 http://www.nmr-relax.com/
2 http://www.nmr-relax.com/manual/Script_mode_spins_from_sequence_file.html
--
Justin Lecher
Institute of Complex Systems
ICS-6 Structural Biochemistry
Research Centre Juelich
52425 Juelich, Germany
phone: +49 2461 61 2117
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