Bureaucrats, cc_docs_admin, cc_staff
2,879
edits
NAMD: Difference between revisions
Jump to navigation
Jump to search
no edit summary
(Marked this version for translation) |
No edit summary |
||
| Line 341: | Line 341: | ||
<!--T:67--> | <!--T:67--> | ||
After this the namd3 executable located in that directory will be | After this the <code>namd3</code> executable located in that directory will be linked to the correct libraries on our systems. | ||
You can then submit a GPU job that uses that executable. | You can then submit a GPU job that uses that executable. | ||
<!--T:68--> | |||
For best performance, we recommend adding the following keyword to the configuration file: | |||
< | </translate> | ||
CUDASOAintegrate on | |||
<translate> | |||
Please see the [https://www.ks.uiuc.edu/Research/namd/alpha/3.0alpha/ NAMD 3.0 Alpha web page] for more on this parameter and related changes in NAMD 3. | |||
= References = <!--T:23--> | = References = <!--T:23--> | ||