Hi
>In the molecular system editor in the lower, chain fragments table you
>can set the starting sequence number for each fragment.
>
>To make a chain with two discontinuous sections you must first create a
>molecule with two sections. Simply do this by adding poylmer residues
>twice for the same molecule. A chain built using this moecule template
>will show two chain fragments, for which you can set different start
>sequence numbers, as long as the numbering would not overlap.
>
This works very nicely, thank you. I never realised you could make fragments
of chains.
If I do this then is it correct that as far as Analysis is concerned the end
of fragment 1 is connected to the start of fragment 2? I guess it is.
Also, about removing molecular systems like Wayne suggested
>>> expt = top.nmrProject.findFirstExperiment(name=...)
>>> molSystem = top.project.findFirstMolSystem(code='MS1')
>>> expt.removeMolSystem(molSystem)
How do I get this to work? I typed this in at the python prompt and I get
syntax errors, I also tried changing the ... to the relevant Experiment name
and that also failed. Which bits do I need to change to get this to work OK?
Cheers
Ben
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