ACKNOWLEDGEMENT: autoPROC and Clemens Vonrhein; DOIs verified; DISTL; tNCS credit in MR
- All 84 DOIs checked (82 on Crossref, 2 DataCite): title, journal, volume, pages and first author match; Matthews 1968 and Yeates 1997 links percent-encode their parentheses; the MOSFLM link points at a page that answers. - autoPROC: an explicit acknowledgement of Clemens Vonrhein (Global Phasing) for the principle that a pipeline should verify the metadata it is given - beam centre, geometry, goniometer - and correct it where it is wrong; Vonrhein et al. (2011) Acta Cryst. D67, 293-302 (DOI checked). - Zhang, Sauter et al. (2006) DISTL, already credited in SpotFindingSettings.h, gets its entry. - Molecular replacement: tNCS looked for in the native Patterson as Read, Adams & McCoy do; the same credit at DetectTranslationalNcs (comment only). Co-Authored-By: Claude Opus 5.5 (1M context) <noreply@anthropic.com> Claude-Session: https://claude.ai/code/session_01EizBKhTqrAYago9KJG3dA3
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@@ -1603,6 +1603,7 @@ LikelihoodPeak LikelihoodTranslationZ(const LikelihoodSetup &setup, const std::v
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// --- translational NCS ---
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// Following Read, Adams & McCoy (2013) Acta Cryst. D69, 176-183
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TranslationalNcs DetectTranslationalNcs(const std::vector<MergedReflection> &merged, const gemmi::UnitCell &cell,
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const gemmi::SpaceGroup &sg) {
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constexpr double D_MIN = 5.0, D_MAX = 10.0, MIN_DISTANCE_A = 15.0, MIN_HEIGHT = 0.2;
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