Hi,
What is the relation between pulling force and free energy of binding. can
we relate the maximum pulling force with the free energy. for example, 2
systems has the maximum pulling force and free energy as below from
umbrella sampling and g_wham analysis,
max. force free energy
system 1 1470 42
system 2 1647 32
system 2 has higher pulling force than system 1 and the free energy result
is different from this trend.
Regards,
Vijay.
--
gmx-users mailing list [email protected]
http://lists.gromacs.org/mailman/listinfo/gmx-users
Please search the archive at
http://www.gromacs.org/Support/Mailing_Lists/Search before posting!
Please don't post (un)subscribe requests to the list. Use the
www interface or send it to [email protected].
Can't post? Read http://www.gromacs.org/Support/Mailing_Lists