[gmx-users] after g_morph, how to calculate energies?
    Rongliang Wu 
    wurl04 at iccas.ac.cn
       
    Sun Apr 30 10:43:45 CEST 2006
    
    
  
Hello, gmx-users,
		i have generated a series of conformations of my molecule using the command "g_morph", but how can i get the correspongding energies for each conformation? 
		if i want to make an estimation of the energies of each conformation of polypropelene(two chain unites), how can i get those conformations which might be beyond the ability of g_morph?
	
Regards
Thanks
 				
        Rongliang Wu
        wurl04 at iccas.ac.cn
          2006-04-30
    
    
More information about the gromacs.org_gmx-users
mailing list