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assigned issue to
Distance Matrix Units
Issue #321
resolved
Hello,
What are the units for the distance matrix. Is it possible to retrieve distances in Angstroms?
Thanks,
Alexander
Comments (7)
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reporter -
The unit is already in Å.
Lars
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reporter - attached script.R
- attached matrix_dist_bet_full.txt
- attached 2j4y_renumber.pdb
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reporter When I run the attached script I seem to be getting units in the thousands. Is there an obvious reason for this in the script?
Thanks, Alexander
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Hi,
Change the line
dm <- dm.xyz(in.inds$xyz)
todm <- dm.xyz(pdb$xyz[in.inds$xyz])
. Note the former is xyz Index NOT xyz Coordinate. -
- changed status to resolved
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- changed version to v2.2
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