Re: Re[2]: [gmx-users] ngmx. molecules or atoms numbers?

On Tue, 24 Jun 2008 11:24:46 +0300 Vitaly Chaban <[EMAIL PROTECTED]> wrote: Xavier, Thank for a clarification. Don't you have any ideas why 'ngmx' can have display->filter dialog inactive? Except the case when index-file in wrong-formatted? No idea! Never used ngmx. Although it seems to be us

Re[2]: [gmx-users] ngmx. molecules or atoms numbers?

Xavier, Thank for a clarification. Don't you have any ideas why 'ngmx' can have display->filter dialog inactive? Except the case when index-file in wrong-formatted? XP> On Tue, 24 Jun 2008 10:26:27 +0300 XP> Vitaly Chaban <[EMAIL PROTECTED]> wrote: >> What numbers (of molecules or of atoms?)

Re: [gmx-users] ngmx. molecules or atoms numbers?

On Tue, 24 Jun 2008 10:26:27 +0300 Vitaly Chaban <[EMAIL PROTECTED]> wrote: What numbers (of molecules or of atoms?) should contain 'index.ndx' in atoms "ngmx -n index.ndx" ? When using 'index.ndx' with molecules numbers it seems to read it as those of atoms and when using 'index.ndx' with

[gmx-users] ngmx. molecules or atoms numbers?

What numbers (of molecules or of atoms?) should contain 'index.ndx' in "ngmx -n index.ndx" ? When using 'index.ndx' with molecules numbers it seems to read it as those of atoms and when using 'index.ndx' with atoms it just refuses to start (the section appeared in display->filter is inactive, I