ENH: Specify bounds for the to-be optimized ligand vector when computing cone angles #120
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Codecov Report
@@ Coverage Diff @@
## master #120 +/- ##
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- Coverage 53.80% 53.79% -0.02%
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Files 36 36
Lines 2888 2887 -1
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- Hits 1554 1553 -1
Misses 1334 1334
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The reduction in size of the optimization space seems to improve the final cone angles a bit.