[gmx-users] Can I keep the chirality character when I use the united atom force filed?

Hanming hanming at iccas.ac.cn
Mon Jun 21 16:45:29 CEST 2004

Hi, All, 

There is some carbon atoms which have the chirality in my molecules.
Because the molecule is big I want to use the united atom force filed. But
will this simulation hide the chirality character of the atoms? Or can I
add some potential to keep them? 



More information about the gromacs.org_gmx-users mailing list