Hi there, I came across an error when trying to set the average point number for extrapolation, using post_update_options.extrapolate.points in settings.xml. The error says: *Unknown option '--avg-points'. * The error occurs while running potential_extrapolate.sh. I go through the script, and it seems that the option is *avg-point. *However*, t*he false command is automatically generated by postupd_extrapolate.sh (*--avg-points* ). Is there a mismatch between these two scripts? I tried to change one of them, but same error occurs. Should I re-install votca to make the change happen?
I have attached parts of the logfile and setting.xml, in case it is not like what I thought. Thanks Yihan -- You received this message because you are subscribed to the Google Groups "votca" group. To unsubscribe from this group and stop receiving emails from it, send an email to [email protected]. To view this discussion on the web visit https://groups.google.com/d/msgid/votca/b4ca92ec-b36d-4b5a-b9ce-24b4458e5453%40googlegroups.com.
<<attachment: tovotca.zip>>
