On Sun, Oct 01, 2017, Roma Mukhopadhyay wrote:
>
> ERROR: nfft1 must be in the range of 6 to 512!" and "ERROR:
> fft_blk_y_divisor must be in the range of 2 to 1!
>
> Is this issue related to the presence of multiple TER cards in the pdb
> file containing the initial molecules?
No.
How big is your periodic box? This error likely comes from having a very
large (or possibly, very small) box.
....dac
_______________________________________________
AMBER mailing list
AMBER.ambermd.org
http://lists.ambermd.org/mailman/listinfo/amber
Received on Sun Oct 01 2017 - 13:30:02 PDT