Timestamp:
Mar 16, 2024, 10:22:50 AM (20 months ago)
Author:
Frederik Heber <frederik.heber@…>
Branches:
Candidate_v1.7.0, stable
Children:
c099dc
Parents:
9782e20
git-author:
Frederik Heber <frederik.heber@…> (03/16/24 09:40:05)
git-committer:
Frederik Heber <frederik.heber@…> (03/16/24 10:22:50)
Message:

BondGraph: returns 1. instead of -1. on miss.

  • when the symmetric matrix did not have an entry or the matrix itself was null, then we returned -1.
  • This was often ued in following computations and ended us finding the atom on the "other" side of a bonded atom than expected.
  • Now, we return always 1. as this is a distance than should be always useful and can be brought to correct lengths in an optimization run.
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