Dear Gromacs Users I download the new gromacs 4.0 and do some tests on protein folding. It seem that there is a matter on outputting trajectory in this version. When the protein is at the boundary of the box, the mdrun will output the protein in some segments. This matter had never found in the preview versions. And It seem that the program trjconv can't correct this matter. Is there someone having ideas about this?
thanks Guanghong
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