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fixed charge group radius LJ check, which could produce too low numbers in the grompp...
commit546c7d3c7c00d7a1ee448f3f95fd982303431f2e
authorBerk Hess <hess@csbl10.(none)>
Wed, 15 Sep 2010 15:28:41 +0000 (15 17:28 +0200)
committerBerk Hess <hess@csbl10.(none)>
Wed, 15 Sep 2010 15:28:41 +0000 (15 17:28 +0200)
tree5540f4a57e36b61b8283a586ae7b115ca3779289tree | snapshot (tar.gz zip)
parent17c75492c21aacd2f4d1688d8c8f72a454d64942commit | diff
fixed charge group radius LJ check, which could produce too low numbers in the grompp notice/warning print
src/gmxlib/chargegroup.c diff | blob | blame | history
The ultimate molecular dynamics simulation package