********>Bugfix 7:
Author: Kateryna Miroshnychenko
Date: 07/10/2006
Programs: ambmask
Description: There is a bad conversion from input charges to internal charge
units.
Fix: apply the following patch to amber9/src/sander/ambmask.f
------------------------------------------------------------------------------
*** ambmask.f 2006-04-04 02:35:54.000000000 +0300
--- ambmask.f 2006-07-10 16:15:48.000000000 +0300
***************
*** 262,268 ****
type = 'CHARGE'
call nxtsec(nf, 6, 0,fmtin, type, fmt, iok)
read(nf,fmt) (chg(i), i=1,natom)
! chg(1:i) = chg(1:i)*INV_AMBER_ELECTROSTATIC
if( iok.eq.-1 ) then ! this is an old-style prmtop file
! old style prmtop has to be read sequentially, even though
--- 262,268 ----
type = 'CHARGE'
call nxtsec(nf, 6, 0,fmtin, type, fmt, iok)
read(nf,fmt) (chg(i), i=1,natom)
! chg(1:natom) = chg(1:natom)*INV_AMBER_ELECTROSTATIC
if( iok.eq.-1 ) then ! this is an old-style prmtop file
! old style prmtop has to be read sequentially, even though
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Temporary workarounds: none