[gmx-users] selections

dgfd dgdfg roinato at mail.ru
Sun Jan 14 15:07:38 CET 2018


Greetings. Please help to solve simple task with gromacs selections.
Say, I have the box with 1000 identical molecules.
How to output the array of "nearest neigbours" (for example by distance between COM <5 Angstroms) for each molecule in the box at the time moment=T.




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