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Vector bugfix #148 #149

Merged
merged 5 commits into from
Mar 29, 2022
Merged

Vector bugfix #148 #149

merged 5 commits into from
Mar 29, 2022

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a-r-j
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@a-r-j a-r-j commented Mar 29, 2022

Reference Issues/PRs

#148

What does this implement/fix? Explain your changes

Changes C-beta vector computation to use pre-computed rgroup df for subsetting. Prevents errors where multiple vectors would be computed for residues with altlocs.

What testing did you do to verify the changes in this PR?

Add example-based tests for problematic PDBs

@a-r-j a-r-j merged commit b458f41 into master Mar 29, 2022
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sonarcloud bot commented Mar 29, 2022

Kudos, SonarCloud Quality Gate passed!    Quality Gate passed

Bug A 0 Bugs
Vulnerability A 0 Vulnerabilities
Security Hotspot A 0 Security Hotspots
Code Smell A 0 Code Smells

No Coverage information No Coverage information
0.0% 0.0% Duplication

@a-r-j a-r-j deleted the vector_bugfix branch May 12, 2022 21:54
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