[gmx-users] RE[2] how to select 'P' atom for g_msd

Vitaly Chaban vvchaban at gmail.com
Thu Jun 26 19:39:00 CEST 2008

>> I have to take only single P atom or all Patoms of
>> POPC biliayer ?

You have to use all the atoms MSDs of which you want to be used for
calculating your diffusion constant.

Vitaly V. Chaban
School of Chemistry
National University of Kharkiv
Svobody sq.,4, Kharkiv 61077, Ukraine
email: chaban at univer.kharkov.ua
skype: vvchaban

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