[gmx-users] help!

xi zhao zhaoxiitc2002 at yahoo.com.cn
Fri May 6 03:03:11 CEST 2005

Dear sir: I want to calculate the number of water between Protein and ligand, I find that  g_density is not suitable for this situaition. Please help me!

David van der Spoel <spoel at xray.bmc.uu.se> 写道:On Thu, 5 May 2005, xi zhao wrote:

>Dear sir: I am a usre of GMX, I need your tool(g_occupancy ) for calculating particles in certain region . Please help me ! thank you in advance.

try g_density

>Do You Yahoo!?

David van der Spoel, PhD, Assoc. Prof., Molecular Biophysics group,
Dept. of Cell and Molecular Biology, Uppsala University.
Husargatan 3, Box 596, 75124 Uppsala, Sweden
phone: 46 18 471 4205 fax: 46 18 511 755
spoel at xray.bmc.uu.se spoel at gromacs.org http://xray.bmc.uu.se/~spoel

gmx-users mailing list
gmx-users at gromacs.org
Please don't post (un)subscribe requests to the list. Use the 
www interface or send it to gmx-users-request at gromacs.org.

Do You Yahoo!?
-------------- next part --------------
An HTML attachment was scrubbed...
URL: <http://maillist.sys.kth.se/pipermail/gromacs.org_gmx-users/attachments/20050506/0c66bca7/attachment.html>

More information about the gromacs.org_gmx-users mailing list