2013/8/22 <[email protected]>: > Dear Users, > > I have one of my potentials in table_B_B.xvg. I wish to move the whole > potential of 1 kj/mol down to see how will that affect other distributions. > Which tool can I use to also have derivatives in the last column? What is the point for this exercise? I can tell you right now, it will have no effect.
If you subtract 1 kj/mol from the potential, the forces will be same and hence the distributions as MD is purely force driven. Christoph > > Steven > > -- > You received this message because you are subscribed to the Google Groups > "votca" group. > To unsubscribe from this group and stop receiving emails from it, send an > email to [email protected]. > To post to this group, send email to [email protected]. > Visit this group at http://groups.google.com/group/votca. > For more options, visit https://groups.google.com/groups/opt_out. -- Christoph Junghans Web: http://www.compphys.de -- You received this message because you are subscribed to the Google Groups "votca" group. To unsubscribe from this group and stop receiving emails from it, send an email to [email protected]. To post to this group, send email to [email protected]. Visit this group at http://groups.google.com/group/votca. For more options, visit https://groups.google.com/groups/opt_out.
