3DNA Forum

Welcome => Bug reports => Topic started by: auffinger on June 07, 2013, 10:34:11 am

Title: rotate_mol small bug
Post by: auffinger on June 07, 2013, 10:34:11 am: Hi Xiang-Jun,

Just ran into a small issue with the new rotate_mol version.
I get a core dump with this file

ATOM 81 H01 DG A 4 0.252 -2.488 17.289 1.00 8.27 H
ATOM 82 H02 DG A 4 3.942 1.573 19.159 1.00 11.82 H
ATOM 70 N9 DG A 4 3.496 1.232 18.319 1.00 11.82 N
ATOM 71 C8 DG A 4 3.617 1.742 17.054 1.00 8.09 C
ATOM 72 N7 DG A 4 2.902 1.118 16.167 1.00 11.07 N
ATOM 73 C5 DG A 4 2.252 0.091 16.894 1.00 11.16 C
ATOM 74 C6 DG A 4 1.310 -0.920 16.456 1.00 9.75 C
ATOM 76 N1 DG A 4 0.906 -1.749 17.502 1.00 8.27 N
ATOM 77 C2 DG A 4 1.340 -1.630 18.818 1.00 8.31 C
ATOM 79 N3 DG A 4 2.218 -0.681 19.223 1.00 9.10 N
ATOM 80 C4 DG A 4 2.629 0.144 18.209 1.00 10.34 C

Could you check ???

Thanks,

Pascal
Title: Re: rotate_mol small bug
Post by: xiangjun on June 07, 2013, 10:38:01 am: Thanks for reporting this bug. I'll get it fixed ASAP.

Xiang-Jun
Title: Re: rotate_mol small bug
Post by: xiangjun on June 07, 2013, 02:07:26 pm: Hi Pascal,

I've fixed the bug in rotate_mol and frame_mol which was introduced in the 2013may02 release to retain original residue and atom names. The updated 3DNA v2.1 release is dated 2013jun07. Please have a try and report back any issues you may have.

Thanks, and have a good weekend!

Xiang-Jun