The regularize command (without a map) tends to move things more than I think they should. Perhaps the end atoms should be fixed. How would one restrain atoms to their starting coordinates? From the old days I recall Frodo's "REFI" command being better behaved. Any thoughts on this?
Mark Saper Dept of Biological Chemistry, Univ of Michigan sa...@umich.edu _______________________________________________ Mark A. Saper, Ph.D. Associate Professor of Biological Chemistry, U-M Medical School 3040 Chemistry Building | sa...@umich.edu | +1 (734) 764-3353
