[gmx-users] Hello: Forcefield and potentials for DNA-zinc finger complex

2009-05-19 Thread Nehme El Hachem

Hello,

I have a DNA-Zinc finger complex. What are the suitable forcefields  
for that type of complexes (the zinc ion is coordinated to 4  
deprotonated cysteines)?
I need to do some molecular minimization and dynamics including the  
nucelic acid sequence.

Looking for some help.

Thank you.

Nehme

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[gmx-users] Converting pdb to Amber (to use with ffamber99)

2009-08-26 Thread Nehme El Hachem

Hi all,

I am looking for a simple way to convert amino acid and nucleic  
residues from the PDB standard to the AMBER Nomenclature (to use with  
ffamber99 in GROMACS).

Your help is appreciated.

Nehme.

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