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--- cluster:218 [2022/06/30 17:50]
hmeij07 [Testing!]
+++ cluster:218 [2022/07/02 19:34]
hmeij07 [CentOS7 Slurm Template]
@@ Line 336: / Line 336: @@
-  * ''/zfshomes/hmeij/slurm/run.rocky''
+  * ''/zfshomes/hmeij/slurm/run.rocky'' for tinymem, mw128, amber128, test queues
 <code>
@@ Line 452: / Line 452: @@
 Note also that we're running mwgpu's K20 cuda version 9.2 on exx96 queue (default cuda version 10.2). Not proper but it works. Hence this script will run on both queues. Oh, now I remember, it is that amber16 was compiled with cuda 9.2 drivers which are supported in cuda 10.x but not in cuda 11.x. So Amber 16, if needed, would need to be compiled in Rocky8 environment (and may work like amber20 module).
-  * ''/zfshomes/hmeij/slurm/run.centos''
+  * ''/zfshomes/hmeij/slurm/run.centos'' for mwgpu, exx96 queues
 <code>
@@ Line 507: / Line 507: @@
-###source /usr/local/amber16/amber.sh
-source /usr/local/amber20/amber.sh
+###source /usr/local/amber16/amber.sh # works via slurm's mwgpu
+source /usr/local/amber20/amber.sh # works via slurm's exx96
 # stage the data
 cp -r ~/sharptail/* .
@@ Line 567: / Line 568: @@
 July 2022 is for **testing...** lots to learn!
-Kudos to Abhilash and colin for working our way through all this.
+Kudos to Abhilash and Colin for working our way through all this.
 \\
 **[[cluster:0|Back]]**

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