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cluster:213 [2022/07/25 11:10]
hmeij07 [Amber22]
cluster:213 [2023/01/31 14:25]
hmeij07
Line 73: Line 73:
 iptables -L # check! iptables -L # check!
  
-# Rocky8 +
-# https://docs.fedoraproject.org/en-US/epel/#Quickstart +
-dnf config-manager --set-enabled powertools +
-dnf install epel-release +
-dnf install netcdf netcdf-devel +
-dnf install yum-utils # yumdownloader +
-dnf install ddd  +
-dnf install grace +
-dnf install gnuplot +
-dnf install alpine # pico +
-yum groupinstall "Server" # server for compute nodes "Server with GUI"+
  
 # other configs # other configs
 vi /etc/selinux/config # disabled, do not mistype, kernel will not boot! vi /etc/selinux/config # disabled, do not mistype, kernel will not boot!
 mv /home /usr/local/ mv /home /usr/local/
 +cd /;ln -s /usr/local/home 
 +cd /; ln -s /home /share
 vi /etc/passwd (exx, dockeruser $HOME) vi /etc/passwd (exx, dockeruser $HOME)
  
Line 94: Line 86:
 ## cottontail2 = greentail52 sections ## cottontail2 = greentail52 sections
  
 +#exx96
 mkdir /sanscratch /home/localscratch mkdir /sanscratch /home/localscratch
 chmod ugo+rwx /sanscratch /home/localscratch chmod ugo+rwx /sanscratch /home/localscratch
 chmod o+t /sanscratch /home/localscratch  chmod o+t /sanscratch /home/localscratch 
 +# exx96
 # link localscratch in 1.4T /home to / # link localscratch in 1.4T /home to /
-mkdir /home  + 
-cd /home # local dir+cd /home 
 ln -s /zfshomes/apps ln -s /zfshomes/apps
 ln -s /zfshomes/tmp ln -s /zfshomes/tmp
 ln -s /zfshomes/csmith06 ln -s /zfshomes/csmith06
-ln -s /zfshomes /share+
  
 # fstab file mounts # fstab file mounts
 +mkdir -p /zfshomes /home66 /home33 /mindstore /opt/ohpc/pub /opt/intel
 # cottontail2 = greentail52 # cottontail2 = greentail52
 # n100-n101 = n79 # n100-n101 = n79
  
-# postfix 
-dnf install postfix 
-dnf install mailx 
-systemctl enable postfix 
-echo "relayhost = 192.168.102.251" >> /etc/postfix/main.cf 
  
 # on head node /etc/chronyc.conf # on head node /etc/chronyc.conf
Line 123: Line 113:
 # check # check
 chronyc sources chronyc sources
 +
 +# Rocky8
 +# https://docs.fedoraproject.org/en-US/epel/#Quickstart
 +dnf config-manager --set-enabled powertools
 +dnf install epel-release
 +dnf install netcdf netcdf-devel
 +dnf install yum-utils # yumdownloader
 +dnf install ddd 
 +dnf install grace
 +dnf install gnuplot
 +dnf install alpine # pico
 +yum groupinstall "Server" # server for compute nodes "Server with GUI"
  
  
Line 168: Line 170:
 # compute nodes old level 3 # compute nodes old level 3
 systemctl set-default multi-user.target systemctl set-default multi-user.target
 +
 +
 +# postfix
 +dnf install postfix
 +dnf install mailx
 +systemctl enable postfix
 +echo "relayhost = 192.168.102.251" >> /etc/postfix/main.cf
 +
 +yum install net-snmp-utils net-snmp-libs net-snmp net-snmp-agent-libs
 +
 +# edit /etc/snmp/snmpd.conf, enable and start
 +rocommunity public
 +dontLogTCPWrappersConnects yes
 +# enable, start, add to zenoss 
 +
  
 # compute nodes only # compute nodes only
Line 243: Line 260:
  libhwloc.so.15 => /opt/ohpc/pub/libs/hwloc/lib/libhwloc.so.15 (0x00007fd6e5684000)  libhwloc.so.15 => /opt/ohpc/pub/libs/hwloc/lib/libhwloc.so.15 (0x00007fd6e5684000)
  
-# add to zenoss edit /etc/snmp/snmpd.conf, enable and start +
-rocommunity public +
-dontLogTCPWrappersConnects yes+
  
 </code> </code>
Line 373: Line 388:
  
 # copy head node's amber22_src/ to n100:/usr/local/src/tmp/ # copy head node's amber22_src/ to n100:/usr/local/src/tmp/
 +
 +
 +source /share/apps/CENTOS8/ohpc/software/amber/22/amber.sh
 +echo $AMBERHOME
  
 # install latest openmpi version # install latest openmpi version
Line 378: Line 397:
 tar xvfj ../../../../openmpi-4.1.4.tar.bz2  tar xvfj ../../../../openmpi-4.1.4.tar.bz2 
  
 +./configure_openmpi gnu # openhpc gcc/gfortran 
  
  
 +# on n100 now, parallel, set 
 +-MPI=TRUE
 +-DDOWNLOAD_MINICONDA=FALSE
 +./run_cmake
 +make install
  
 +# on n100 just change cuda flag
  
 +[hmeij@n100 build]$ module load cuda/11.6
 +[hmeij@n100 build]$ which gcc mpicc nvcc
 +/opt/ohpc/pub/compiler/gcc/9.4.0/bin/gcc
 +/share/apps/CENTOS8/ohpc/software/amber/22/bin/mpicc
 +/usr/local/cuda/bin/nvcc
 +[hmeij@n100 ~]$ echo $CUDA_HOME
 +/usr/local/cuda
  
-# Env+-MPI=TRUE 
 +-CUDA=TRUE 
 +-DDOWNLOAD_MINICONDA=FALSE 
 +./run_cmake 
 +make install
  
-[hmeij@n100 ~]$ module load cuda/11.6 
- 
-[hmeij@n100 ~]$ echo $CUDA_HOME 
-/usr/local/cuda 
  
 [hmeij@n100 ~]$ which nvcc mpicc gcc [hmeij@n100 ~]$ which nvcc mpicc gcc
Line 394: Line 427:
 /opt/ohpc/pub/mpi/openmpi4-gnu9/4.1.1/bin/mpicc /opt/ohpc/pub/mpi/openmpi4-gnu9/4.1.1/bin/mpicc
 /opt/ohpc/pub/compiler/gcc/9.4.0/bin/gcc /opt/ohpc/pub/compiler/gcc/9.4.0/bin/gcc
- 
-# [FIXED} cmake error on conda install, set to FALSE 
-# OS native python, install on n[100-101] 
--- Python version 3.9 -- OK 
--- Found PythonLibs: /usr/lib64/libpython3.9.so (found version "3.9.6" 
--- Checking for Python package numpy -- not found 
--- Checking for Python package scipy -- not found 
--- Checking for Python package matplotlib -- not found 
--- Checking for Python package setuptools -- found 
-[END FIXED] 
- 
-# mpi & cuda FALSE builds serial 
-./run_cmake 
-make install 
-# lots and lots of warnings 
- 
-# then 
-source /share/apps/CENTOS8/ohpc/software/amber/20/amber.sh 
- 
-# on n100 now, parallel, set miniconda flags to FALSE 
--MPI=TRUE 
-./run_cmake 
-make install 
- 
-# on n100 just change cuda flag 
--CUDA=TRUE 
-./run_cmake 
-make install 
  
 #tests #tests
cluster/213.txt · Last modified: 2024/01/12 10:09 by hmeij07