CCL: Stochastic Search for Isomers



 Sent to CCL by: errol lewars [elewars[-]trentu.ca]
 2010 March 02
 Re stochastic searches for isomers;
 1
 
M. Saunders, "Stochastic search for isomers...", J Comp Chem, 2004, 25(5), 621-626.
 2
 
P P Bera et al., "Mindless Chemistry", J Phys Chem A, 2006, 110(13), 4287-4290.
 E. Lewars
 ==
 Dr. Xiaofeng (Frank) Duan duanx.ctr#%#afrl.hpc.mil wrote:
 
 Sent to CCL by: "Dr. Xiaofeng (Frank) Duan" [duanx.ctr_._afrl.hpc.mil]
 Hi all,
 
Does anyone know any programs that have features to generate and filter out stable isomers for a set of atoms (around 8-10 atoms)?
 Thanks!
 Frank Duan
 
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