On Wed, Nov 27, 2019, Chuan Tian wrote:
>
>If you update the amber19 properly, you will find that the test in
>$AMBERHOME/test/cuda/ff19SB will actually use inpcrd in
>$AMBERHOME/test/ff19SB instead.
Just to expand on what Chuan said: this problem is addressed in update.9
to AmberTools19. Use the $AMBERHOME/update_amber script to be sure you
are up to date.
....dac
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Received on Thu Nov 28 2019 - 06:00:02 PST
