On 24/08/17 16:29, Dr A.A. Jalan wrote:
I am trying to change the default refmac run parameters in coot. For
this, I created a refmac-extra-params file in the directory from where
coot is launched.
(set! refmac-extra-params (list "MAKE HYDROGENS ALL" "REFI BREF ANIS"))
You can set refmac-extra-params in 2 ways. Either add to your ~/.coot file:
(set! refmac-extra-params (list "MAKE HYDROGENS ALL" "REFI BREF ANISO"))
or recreate a file called refmac-extra-params (like you have done) with
contents
MAKE HYDROGENS ALL
REFI BREF ANISO
Sorry if that was not clear in the documentation.
Regards,
Paul.
