hori koshii wrote:
Hi all, just a short question to make sure if:the assess_dope method in MODELLER accounts for all atoms when calculating the dope energy profile for each residue?
DOPE is calculated for all heavy atoms. See modlb/atmcls-mf.lib for the defined atom types, and for more detail the DOPE publication: http://salilab.org/pdf/174_SheSalProtSc2006.pdf
Ben Webb, Modeller Caretaker -- http://www.salilab.org/modeller/ Modeller mail list: http://salilab.org/mailman/listinfo/modeller_usage