 David Sehnal
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dd6dcddaba
Update Structure construction from Model
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%!s(int64=7) %!d(string=hai) anos |
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David Sehnal
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52a8a0e55b
Merge "single residue units" together in Structure.ofModel
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%!s(int64=7) %!d(string=hai) anos |
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David Sehnal
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a81db69edc
Only keep modified residue name mapping
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%!s(int64=7) %!d(string=hai) anos |
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David Sehnal
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0b9f31b45e
Mod res support
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%!s(int64=7) %!d(string=hai) anos |
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David Sehnal
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565a5ed92e
Added InterUnitLinks and renamed "bonds" to "links"
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%!s(int64=7) %!d(string=hai) anos |
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David Sehnal
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2a3f2e9969
Added UnitRings
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%!s(int64=7) %!d(string=hai) anos |
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David Sehnal
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e3f49b61a1
Sequence as more 1st class citizen
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%!s(int64=7) %!d(string=hai) anos |
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David Sehnal
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369ff8e54c
Added IntGraph and using it for IntraUnitBonds
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%!s(int64=7) %!d(string=hai) anos |
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David Sehnal
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ac1e2b0d51
Query wholeResidues, includeSurroundings
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%!s(int64=7) %!d(string=hai) anos |
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David Sehnal
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59f5f0caec
Parse sec struct from mmCIF
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%!s(int64=7) %!d(string=hai) anos |
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David Sehnal
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dd475dc679
Refactored Task to use run/runAsChild calls on the object itself
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%!s(int64=7) %!d(string=hai) anos |
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David Sehnal
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3580533276
Wrap Model.create in Task
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%!s(int64=7) %!d(string=hai) anos |
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David Sehnal
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ba2a4f3a99
More refactoring of mol-model
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%!s(int64=7) %!d(string=hai) anos |
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David Sehnal
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efa5ef1bd5
IntraUnitBonds and other stuff
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%!s(int64=7) %!d(string=hai) anos |
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David Sehnal
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0427d52d97
Updated mol-geo to new Structure data model
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%!s(int64=7) %!d(string=hai) anos |
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David Sehnal
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c2882b3e41
Coarse unit tweaks, string hash
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%!s(int64=7) %!d(string=hai) anos |
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David Sehnal
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31eb9ae4bb
Updated coarse unit model
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%!s(int64=7) %!d(string=hai) anos |
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David Sehnal
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ce3c3d6493
VolumeData
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%!s(int64=7) %!d(string=hai) anos |
