Thank you. I will use position geometry.
I will actually need to rerun whole thing with slightly different peptide, so at the end I will not need those curves with recreated tpr-files. But at least I will now get pull code right from beginning and I got bit more understanding on pull code issues. -Anni -- ************************************************ Anni Kauko, Ph.D. Post Doctoral Researcher Structural Bioinformatics Laboratory Dept. of Biosciences, Biochemistry Åbo Akademi University 20520 Turku, Finland phone: +358 (0)2 215 4006 mobile: +358 (0)50-576 8656 ************************************************
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