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Ano-ano sequence in DGlcpa1-2DGlcpa1-2DFrufb1-2DFrufb is missing metadata #13

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gitoliver opened this issue Feb 6, 2025 · 0 comments
Open

Ano-ano sequence in DGlcpa1-2DGlcpa1-2DFrufb1-2DFrufb is missing metadata #13

gitoliver opened this issue Feb 6, 2025 · 0 comments
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The error generated by gmml2 when I add this to the test suite in gmml2 is:

Building DGlcpa1-2DGlcpa1-2DFrufb1-2DFrufb

Error thrown by the carbohydrateBuilder in gmml during construction was: Insufficient metadata found for the linkage between 2CU and 2CU. Missing metadata for dihedral 3: [C1, O2, C2, C1]

I need to add metadata for this. Note the ano-ano is here:
DGlcpa1-2DGlcpa1-2DFrufb1-2DFrufb
@gitoliver gitoliver added the bug Something isn't working label Feb 6, 2025
@gitoliver gitoliver self-assigned this Feb 6, 2025
@gitoliver gitoliver changed the title Ano-ano sequence in DGlcpa1-2DGlcpa1-2DFrufb1-2DFrufb causing segfault Ano-ano sequence in DGlcpa1-2DGlcpa1-2DFrufb1-2DFrufb is missing metadata Feb 6, 2025
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