Re: [ccp4bb] Refmac5 update water option

2016-12-16 Thread Xiao Lei
Got it. Thank you very much Christian! On Fri, Dec 16, 2016 at 12:14 PM, Christian Roth wrote: > Hi, > > the adding water option is basically a COOT script to find waters, which > get subsequently refined. There is no automatic evaluation and deletion of > waters based on certain criteria. That

Re: [ccp4bb] Refmac5 update water option

2016-12-16 Thread Christian Roth
Hi, the adding water option is basically a COOT script to find waters, which get subsequently refined. There is no automatic evaluation and deletion of waters based on certain criteria. That you have to do manually. You can always try to automatically add new waters, which is done by this opt

[ccp4bb] Refmac5 update water option

2016-12-16 Thread Xiao Lei
Dear CCP4bb members, Does Refmac5 in CCP4i have an option of adding waters to the refined structure (the input coordinate does not have any water)? I see in Phenix refine there is an option of "update water", I tried to look for this option in Refmac5 but I could not find it. I am using CCP4i 7.0