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Allow manual specification of asym_id #8

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benmwebb opened this issue Apr 5, 2018 · 0 comments
Closed

Allow manual specification of asym_id #8

benmwebb opened this issue Apr 5, 2018 · 0 comments
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enhancement New feature or request

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@benmwebb
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benmwebb commented Apr 5, 2018

Currently all IDs are hidden away and assigned automatically. This includes asym_ids (chain IDs). However, it may be helpful to allow these to be manually specified, for example if people want to keep the chain IDs from a starting model. We just need to check for duplicate manual IDs, and that any automatically-assigned IDs do not clash with manually-assigned ones.

@benmwebb benmwebb added the enhancement New feature or request label Apr 5, 2018
@benmwebb benmwebb self-assigned this Apr 5, 2018
benmwebb added a commit that referenced this issue Jul 26, 2018
If we encounter an unquoted token that starts with #,
skip everything to the end of the line (it is a comment).
Previously this was erroneously treated as one or more values,
causing the reader to fail to read PDB-Dev entry #8 when it
encountered the loop construct
_ihm_cross_link_restraint.distance_threshold #distance of the optimization
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