Dear All,
i need help! i tried to run minimization on an
extended protein with 573 residues in vacuo (serial
run) , and i got this error:
4. RESULTS
--------------------------------------------------------------------------------
---------------------------------------------------
eedmeth=4: Setting switch to one everywhere
---------------------------------------------------
nfft1-3 too large! check on MAXNFFT in ew_bspline.h
i tried to increase the MAXNFFT in ew_bspline.h from
500 to 5000, unfortunately it didnt work out and still
gave the same error, should i increase it to larger
value or it it something else?
i need some advice on this matter
thank you very much in advance
kind regards
__________________________________
Yahoo! Mail
Stay connected, organized, and protected. Take the tour:
http://tour.mail.yahoo.com/mailtour.html
-----------------------------------------------------------------------
The AMBER Mail Reflector
To post, send mail to amber.scripps.edu
To unsubscribe, send "unsubscribe amber" to majordomo.scripps.edu
Received on Thu Aug 18 2005 - 04:53:00 PDT
