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--- howto:dlpoly [2016/03/30 11:57]
kgovender
+++ howto:dlpoly [2024/08/12 13:30] (current)
alopis
@@ Line 3: / Line 3: @@
 These include DLPOLY 1.9 (also known as DLPOLY classic), DLPOLY 4.07 and DLPOLY 4.08.
 As such there are different scripts available on the login node for PBS job creation and submission.
-To run any or these scripts execute **qdlpoly_1.9**, **qdlpoly_4.07** or **qdlpoly_4.08** in the directory that has your input files for your job
+To run any or these scripts execute **qdlpoly_1.9**, **qdlpoly_2.20**, **qdlpoly_3.09**, **qdlpoly_4.07** or **qdlpoly_4.08** in the directory that has your input files for your job.
 Please ensure CONFIG, CONTROL and FIELD files are located in submission directory or no PBS will be generated.
+**Note**, please first include this **module load** - even better if your add this line to your .bashrc, then the Easy Scripts should be visible and available:
+  module load chpc/easy_scripts
 Examples of input required for these scripts are provided below.

wiki.chpc.ac.za