Difference between revisions of "DL Poly Classic Installation"
From Supercomputación y Cálculo Científico UIS
| (5 intermediate revisions by the same user not shown) | |||
| Line 1: | Line 1: | ||
__NOTOC__ | __NOTOC__ | ||
| + | Back to [[DLPoly]] | ||
| − | + | == DL Poly Classic Installation == | |
| − | + | ''' DL Poly Classic 1.9 on Debian 7.0 ''' | |
| − | + | === Installation === | |
| − | + | 1. First you need to check if Tcsh is intalled | |
| − | + | {{Command|<nowiki>aptitude install tcsh</nowiki>}} | |
| − | + | 2. Go to and check the download instructions: | |
| − | + | http://www.ccp5.ac.uk/DL_POLY_CLASSIC/ | |
| − | + | {{Note|<nowiki>Check MPI and basic libraries</nowiki>}} | |
| − | + | 3. Download and untar in a common location, for instance /usr/local/ | |
| − | + | 4. Edit /etc/profile.d/apps.sh and add the following lines. Then replicate these changes in the apps.sh file of every node. | |
| − | |||
| − | |||
| − | 1. First you need to check | ||
| − | {{Command|<nowiki>aptitude | ||
| − | |||
| − | |||
| − | |||
| − | |||
| − | |||
| − | |||
| − | |||
| − | |||
| − | |||
| − | |||
| − | |||
| − | |||
| − | |||
| − | |||
| − | |||
| − | |||
| − | {{Note|<nowiki> | ||
| − | |||
| − | |||
| − | |||
{{File|/etc/profile.d/apps.sh|<pre><nowiki> | {{File|/etc/profile.d/apps.sh|<pre><nowiki> | ||
... | ... | ||
| − | export | + | #DL Poly Classic |
| − | + | export PATH=$PATH:/usr/local/dl_class_1.9 | |
| − | |||
... | ... | ||
| − | </nowiki></pre>}} | + | </nowiki></pre>}}5. Test using the test exercises found in the same location of the sources. |
| − | + | {{Note|<nowiki>The Java GUI can't be installed. It should be installed in the client machine and the proyect files uploaded</nowiki> }} | |
| − | |||
| − | |||
| − | </ | ||
Latest revision as of 20:17, 27 June 2016
Back to DLPoly
DL Poly Classic Installation
DL Poly Classic 1.9 on Debian 7.0
Installation
1. First you need to check if Tcsh is intalled
aptitude install tcsh
2. Go to and check the download instructions: http://www.ccp5.ac.uk/DL_POLY_CLASSIC/
NOTE: Check MPI and basic libraries
3. Download and untar in a common location, for instance /usr/local/ 4. Edit /etc/profile.d/apps.sh and add the following lines. Then replicate these changes in the apps.sh file of every node.
File: /etc/profile.d/apps.sh
... #DL Poly Classic export PATH=$PATH:/usr/local/dl_class_1.9 ...
5. Test using the test exercises found in the same location of the sources.
NOTE: The Java GUI can't be installed. It should be installed in the client machine and the proyect files uploaded
