GEO_OPT with constrained distances

Lavinia ariell... at gmail.com
Thu Apr 10 00:54:58 CEST 2014


Dear experts,

How can I setup a geometry optimization calculation with constrained 
distances i.e. how do I keep colvars at constant values in GEO_OPT? Could 
you please provide some sample input?

Sincerely,
Lavinia
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