gurgo>> Vitaly Chaban wrote: >>> Hello, >>> >>> Where can I read about the exact format of the TRR and XTC files. I >>> mean the width and type of every field in the binary trajectory file. >>> >>> I see read_'next_frame(status,&fr)' function in 'template.c'. But >>> where is this fuction defined? >>> Sorry, I'm not an expert in C. :( >>> >>> Thanks. >>> gurgo>> Make your life easier by just using the supplied functions to read the gurgo>> files. Check any analysis program.
VC> Thank you very much. Initially I supposed to write my trajectory VC> analysis programme not in C (and thereby wanted to read trajectory VC> from my programme) but after your suggestion and looking into VC> the deeply hidden functions in gromacs I comply to code it in C using the VC> already existing tools. :) However it seems to be very well if in the next version of the tutorial the exact format of trajectory files is explicitly shown. It will make life easier for many those who would like to compose their utilities not in C but for example in some scripting languages, etc. _______________________________________________ gmx-users mailing list gmx-users@gromacs.org http://www.gromacs.org/mailman/listinfo/gmx-users Please search the archive at http://www.gromacs.org/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/mailing_lists/users.php
