Hi Sam,
> Hi, the question may be a bit weird, but how do you define 'over-fitting' > in the context of structure refinement? From users' perspective the > practical aspect is to 'fit' the model into the density. So there comes > this question from our juniors: fit is fit, how is a model over-fit? > this is a good question for which there is an answer. I suggest reading classics on the matter: https://www.nature.com/articles/355472a0 https://atbweb.stanford.edu/atb_publications/brunger_kleywegt_struct_1996.pdf https://www.sciencedirect.com/science/article/pii/S0076687997770216 https://pubmed.ncbi.nlm.nih.gov/15299543/ https://journals.iucr.org/d/issues/1998/04/00/ad0030/ad0030.pdf and numerous references therein. That should set the scene for the next questions to ask. Good luck! Pavel ######################################################################## To unsubscribe from the CCP4BB list, click the following link: https://www.jiscmail.ac.uk/cgi-bin/WA-JISC.exe?SUBED1=CCP4BB&A=1 This message was issued to members of www.jiscmail.ac.uk/CCP4BB, a mailing list hosted by www.jiscmail.ac.uk, terms & conditions are available at https://www.jiscmail.ac.uk/policyandsecurity/
