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--forwrev should be non-zero by default #18

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hejamu opened this issue Nov 21, 2022 · 0 comments · Fixed by #20
Closed

--forwrev should be non-zero by default #18

hejamu opened this issue Nov 21, 2022 · 0 comments · Fixed by #20
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@hejamu
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hejamu commented Nov 21, 2022

Setting forwrev to 0 results in an empty dataframe in forward_backward_convergence which breaks other stuff, making flamel unusable unless --forwrev != 0 is specified.

@xiki-tempula xiki-tempula mentioned this issue Dec 2, 2022
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orbeckst pushed a commit that referenced this issue Dec 3, 2022
* fix #18 
* make --forwrev=0 switch to the default None when calling ABFE (avoids a nasty crash when the 
  original default 0 is not changed)
* add test for flamel invocation with default parameters
* Update CHANGES

Co-authored-by: Henrik Jaeger <info@jaegerhenrik.de>
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