AMBER Archive (2004)Subject: Re: AMBER: bug of leap?
From: Ye Mei (ymei_at_itcc.nju.edu.cn)
Date: Wed Apr 07 2004 - 21:40:29 CDT
Dear amber users,
I found that it seems when the sequence of H is over 10, its name will be changed. But the name in top file saved by "saveamberparm" command is correct.
======= 2004-04-08 10:27:11 =======
>Dear amber users£¬
>
>I found that leap renames the atoms in pdb file, even though they have the same name with those in prepi file.
>Attached are files in my test. DPC083.prepi is the prepi file, 1_1.pdb is the original pdb file and 1_1_2.pdb is the output. Leap command is in leapin. The names of the last two atoms have been changed.
>Could anyone solve this problem?
>
>¡¡¡¡¡¡¡¡¡¡¡¡
>
>Best regards,
>
>Ye Mei
>ymei_at_itcc.nju.edu.cn
>2004-04-08
= = = = = = = = = = = = = = = = = = = =
¡¡¡¡¡¡¡¡¡¡¡¡¡¡
Best regards,
Ye Mei
ymei_at_itcc.nju.edu.cn
2004-04-08
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