AMBER Archive (2005)

Subject: AMBER: Question about Prep file

From: opitz_at_che.udel.edu
Date: Thu Jul 21 2005 - 15:52:41 CDT

('binary' encoding is not supported, stored as-is) Amber Community,

I downloaded the lanthanide parameters from the AMBER parameter webpage (http://pharmacy.man.ac.uk/amber/) lanthanides, Eu(3+), La(3+), Yb(3+) PREP FRCMOD Baaden. After unzipping the prep files, I tried to load the Eu3+ file into leap it stopped with the message "Unexpected EOF: discarding residue ( -50 -50)".Why is this? Is this prep format an older format? How would I have to
modify the file to get it to work?
I have pasted the body of the file below as well.

Best Regards,

Armin

M XYZ 1 1 1 1 2 1
E EU Eu
 -50 -50
 -50 -50 -50
 -50 -50 -50 -50
   1
   0
   0 1 2 0
   1
   0
  3.0000
  -0.03100 -0.20000 0.22700

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