Re: [AMBER] MM-PBSA calculation

From: Elvis Martis <>
Date: Fri, 27 Oct 2017 15:53:02 +0000

Please consider using Ambertools17.
And try to run or

Best Regards
Elvis Martis
Mumbai, INDIA.

From: Mustafa Alhaji Isa <>
Sent: 27 October 2017 20:52
To: AMBER Mailing List
Subject: [AMBER] MM-PBSA calculation

Dear All,

I want calculate MM-PBSA using amber10, but when I run the below
command using the attached script obtained from the tutorial, it
display the following error "Unable to read script file because of
error: ERROR! -o option must have argument"

Input file for running PB and GB in serial
   endframe=50, keep_files=2,
  igb=2, saltcon=0.100,
/ -O -i -o MMPBSA.dat -sp cmk49_solv.prmtop -cp
cmk49.prmtop -rp cmk.prmtop -lp 49.prmtop y prod.mdcrd

Warm regards
Mustafa Alhaji Isa
AMBER mailing list
Received on Fri Oct 27 2017 - 09:00:02 PDT
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