On Wed, Dec 19, 2018 at 6:58 PM Zhang Shenqiu <[email protected]> wrote:
> Dear Everyone, > > I am a beginner to Gromacs, and found Gromacs can be installed with > apt-get install gromacs on Debian/Ubuntu. But I hesitate to use it because > this option is not listed or mentioned in the installation guide. > http://manual.gromacs.org/documentation/2018/install-guide/index.html > > I wonder if I am at a disadvantage of using apt-get install, especially > regarding the CUDA functions. I have searched "The gromacs.org_gmx-users > Archives" from December 2018 to September 2016, and couldn't find any > discussion on it. > > Packages in software repositories are compiled generically and therefore will not be optimized for every system. If you want good performance or to use GPU, install from source. -Justin -- ========================================== Justin A. Lemkul, Ph.D. Assistant Professor Office: 301 Fralin Hall Lab: 303 Engel Hall Virginia Tech Department of Biochemistry 340 West Campus Dr. Blacksburg, VA 24061 [email protected] | (540) 231-3129 http://www.thelemkullab.com ========================================== -- Gromacs Users mailing list * Please search the archive at http://www.gromacs.org/Support/Mailing_Lists/GMX-Users_List before posting! * Can't post? Read http://www.gromacs.org/Support/Mailing_Lists * For (un)subscribe requests visit https://maillist.sys.kth.se/mailman/listinfo/gromacs.org_gmx-users or send a mail to [email protected].
