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Avoid re-import of hkl data when solving structures in SHELXT #277

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merged 1 commit into from
Jul 19, 2024

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(DJW fixes) Previous default reimported merged data resulting in loss of useful statistics. xshelxt.scp now uses '-n' flag for shelx2cry.exe
If '-n' is specified, shelx2cry.exe does not put hkl importing code into output.

(DJW fixes) Previous default reimported merged data resulting in loss of useful statistics.
xshelxt.scp now uses '-n' flag for shelx2cry.exe
If '-n' is specified, shelx2cry.exe does not put hkl importing code into output.
@richardicooper richardicooper merged commit 3cae96d into master Jul 19, 2024
10 of 12 checks passed
@richardicooper richardicooper deleted the Improve-SHELXT-script branch July 19, 2024 13:13
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