AMBER: xplor2amber

From: Mahadevan Seetharaman <>
Date: Sat, 2 Aug 2003 21:35:48 -0500 (CDT)


Does anyone have a script to convert xplor format NMR restraints into
amber acceptable input?

I used xplor2amber in midas and the format of my restraint output is

restraint/ at1=XXX /at2=XXX \
/r1=2.500 /r2=3.000 /r3=5.000 /r4=5.500 /k2=20 /k3=20 \
/grpat1=1:H1 \

I am not sure how to make amber read this or to make xplor2amber write
atom numbers at1 and at2.

Thanx in advance,

Mahadevan Seetharaman
Dept. of Chemistry, Univ. of Minnesota
207, Pleasant St. SE Minneapolis, MN 55455
Ph: (612)-624-1535 (O), (216)-382-9769 (H)

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Received on Sun Aug 03 2003 - 03:53:01 PDT
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