On 21/02/2024 02:50, Kim, Sun Kyung wrote:

Thank you Paul for that information. I will look into Acedrg and Grade2!


Sounds good.

I have an unrelated question… I’ve never encountered this before, but all of a sudden my COOT is complaining that it doesn’t have restraints for refinement… (screenshot attached)… any idea why this error message is suddenly appearing?


Coot writes diagnostic information to the terminal/console/program from where it was started. You need to get access to that information.

I would try to start Coot from a terminal and see what it says about dictionaries and libraries as it starts up.

Before invoking coot, you could try setting COOT_MONOMER_LIB_DIR or REFMAC_MONOMER_LIB_DIR to the directory that containers the monomers - how to do that depends on your system.

Regards,

Paul.

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