ligand modeling in binding site of protein
hi i am doing ligand modeling in protein active site i run ligand/multiple-hetero.py script but geting errors it reads the pdb file but at the restraints line it shows one or more atoms not found in model
Mahendra Eknath Awale Institute Scholar M. S. (Pharm.) Dept.of Pharmacoinformatics National Institute of Pharmaceutical Education and Research NIPER S.A.S.Nagar, Mohali, Punjab-160062 INDIA. Institute Web http://www.niper.gov.in/
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mahendra awale wrote: > i am doing ligand modeling in protein active site > i run ligand/multiple-hetero.py script but geting errors > *it reads the pdb file but at the restraints line it shows one or more > atoms not found in model*
I'm not sure what you mean by this - can you post the actual error message, and ideally your input files as well?
Ben Webb, Modeller Caretaker
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Modeller Caretaker