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Revisions №61387

branch: master 「№61387」
Commited by: Daniel Farrell
GitHub commit link: 「973e17960fef37e5」
Difference from previous tested commit:  code diff
Commit date: 2020-08-26 14:42:08

reduce nbr_radius to something reasonable for DNA params (#4933) It would appear dna has had its NBR_RADIUS set to 1000 for a very long time. This isn't super scientific (I just used the calculated radius of GUA from molfile_to_params.py) for all of them (+0.1) Perhaps in the future it might be smart to remake them in-case something else is wrong, but frank says that he has some DNA fixes #4871 and that these params seem to work well for him in that branch so its likely that only the NBR_RADIUS needs to be updated danpf 2020-08-26 NBR WAS set to 1000.0, I set it to the value molfile_to_params.py set for GUA on a single PDB + 0.1 it is possible this could be improved, but this seems good enough for now as it is no longer 1000.0.

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