Discover Minimization Input File
! INPUT FILE FOR DISCOVER GENERATED BY INSIGHT
!
!
overlap = 0.01
begin simulation
* add-automatic bond torsion valence out-of-plane
reduce
!
set dielectric = 1.000000
!
!
!
Minimize
* no cross terms
* no morse
* for 1000 iterations
* using conjugate gradient
* until the maximum derivative is less than 0.001000000 kcal/A
!
!
end
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Last updated: 01/23/2001