BS”D

Dear Mark,


did the .tpr actually match the trajectory file?


Sorry, that was indeed the problem (mismatch of -f and -s files).

Thanks for the hint

Harry




--------------------------------------------------------------------
Harry M. Greenblatt
Associate Staff Scientist
Dept of Structural Biology           
harry.greenbl...@weizmann.ac.il<mailto:harry.greenbl...@weizmann.ac.il>
Weizmann Institute of Science        Phone:  972-8-934-6340
234 Herzl St.                        Facsimile:   972-8-934-3361
Rehovot, 7610001
Israel

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