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cluster:73 [2019/07/17 17:22]
hmeij07 [OpenStructure]
cluster:73 [2019/09/24 12:08]
hmeij07 [R & R/parallel]
Line 43: Line 43:
  
 # setup the environment # setup the environment
-`egrep ^export /share/apps/CENTOS6/openstructure/1.9-install.txt`+egrep ^export /share/apps/CENTOS6/openstructure/1.9-install.txt
  
 ost --help ost --help
Line 55: Line 55:
  
 </code> </code>
 +
 +Remarkably complex compilations.
 +
  
 ====== PyCharm EDU ====== ====== PyCharm EDU ======
Line 70: Line 73:
   * add the bin/ directory to your PATH (see examples on this page)   * add the bin/ directory to your PATH (see examples on this page)
   * http://abacus.gene.ucl.ac.uk/software/paml.html   * http://abacus.gene.ucl.ac.uk/software/paml.html
 +
 +====== Spyder ======
 +
 +  * Spyder: The Scientific Python Development Environment 
 +  * https://docs.spyder-ide.org/index.html
 +  * See Python 3.5.2 for more details
  
 ====== Python3 ====== ====== Python3 ======
  
- --- //[[hmeij@wesleyan.edu|Henk]] 2019/04/25 09:21//+Added to both 3.5.2 versions\\ 
 +''jupyter-notebook'' only runs in 3.5.2 (non-mpi)\\ 
 + --- //[[hmeij@wesleyan.edu|Henk]] 2019/07/23 09:04//
  
-Added to both python versions 3.5.2 and 3.5.2-mpi the following modules all needed for Spyder.+<code> 
 +Successfully installed 
 +Send2Trash-1.5.0 
 +ipywidgets-7.5.0 
 +jupyter-1.0.0 
 +jupyter-client-5.3.1 
 +jupyter-console-6.0.0 
 +notebook-6.0.0 
 +prometheus-client-0.7.1 
 +terminado-0.8.2 
 +widgetsnbextension-3.5.0 
 +json5-0.8.5  
 +jupyterlab-1.0.2  
 +jupyterlab-server-1.0.0  
 +tornado-6.0.3 
 +</code> 
 + 
 + 
 + 
 +Added to both python versions 3.5.2 and 3.5.2-mpi the following modules all needed for Spyder.\\ 
 + --- //[[hmeij@wesleyan.edu|Henk]] 2019/04/25 09:21//
  
-  * Spyder: The Scientific Python Development Environment  
-  * https://docs.spyder-ide.org/index.html 
  
 <code> <code>
Line 232: Line 261:
   * www: http://www.python.org/   * www: http://www.python.org/
  
-====== Kallisto & Trinity ======+====== Kallisto & Trinity & FastQC====== 
 + 
 +**FastQC** A quality control tool for high throughput sequence data. 
 + 
 +  * ''java -version'' latest JDK installed, in default PATH ''which java'' 
 +  * location: /share/apps/FastQC/0.11.8 
 +  * https://www.bioinformatics.babraham.ac.uk/projects/fastqc/ 
  
 **kallisto** is a program for quantifying abundances of transcripts from bulk and single-cell RNA-Seq data, or more generally of target sequences using high-throughput sequencing reads. **kallisto** is a program for quantifying abundances of transcripts from bulk and single-cell RNA-Seq data, or more generally of target sequences using high-throughput sequencing reads.
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 </code> </code>
 +
 +
  
  
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 ====== R & R/parallel ====== ====== R & R/parallel ======
  
 +  * R 3.6.1 (running against "packages", had to comment out libcurl version check)
 +  * New java jdk-12.0.2 (by default in your path)
 +  * packages lme4 and tidyverse installed (dependencies=TRUE)
 +  * https://www.r-bloggers.com/what-are-the-best-machine-learning-packages-in-r/
 +  * packages: mice, rpart, party, caret, randomforest, nnet, e1071, kernLab, xgboost
 +    * note: had to make a link to omp.h from gcc 4.8.4 to OS native gcc...works?
 +
 +<code>
 +
 +  export PATH=/share/apps/CENTOS6/R/packages/bin:$PATH
 +  export LD_LIBRARY_PATH=/share/apps/CENTOS6/R/packages/lib:$LD_LIBRARY_PATH
 +  export PATH=/share/apps/CENTOS6/R/3.6.1/bin:$PATH
 +  export LD_LIBRARY_PATH=/share/apps/CENTOS6/R/3.6.1/lib64:$LD_LIBRARY_PATH
 +  export PATH=/share/apps/CENTOS6/gcc/4.8.4/bin:$PATH
 +  export LD_LIBRARY_PATH=/share/apps/CENTOS6/gcc/4.8.4/lib64:/share/apps/CENTOS6/gcc/4.8.4/lib:$LD_LIBRARY_PATH
 +
 +  #export PATH=/share/apps/java/jdk-12.0.2/bin:$PATH
 +  #export LD_LIBRARY_PATH=/share/apps/java/jdk-12.0.2/lib:$LD_LIBRARY_PATH
 +
 +</code>
  
   * R 3.5.1 (new libcurl package)   * R 3.5.1 (new libcurl package)
-  * Uses same old java home 1.7.0_21, should remember to update+  * Uses same old java home 1.7.0_21 (jdk or jre?), should remember to update
   * package lme4 installed   * package lme4 installed
  
Line 1798: Line 1856:
 export PATH=/home/apps/CENTOS6/R/3.5.1/bin:$PATH export PATH=/home/apps/CENTOS6/R/3.5.1/bin:$PATH
 export LD_LIBRARY_PATH=/home/apps/CENTOS6/R/3.5.1/lib64:$LD_LIBRARY_PATH export LD_LIBRARY_PATH=/home/apps/CENTOS6/R/3.5.1/lib64:$LD_LIBRARY_PATH
 +
 +export PATH=/share/apps/java/jdk1.7.0_21/bin:$PATH
 +export LD_LIBRARY_PATH=/share/apps/java/jdk1.7.0_21/lib:$LD_LIBRARY_PATH
  
 </code> </code>
cluster/73.txt · Last modified: 2024/05/15 12:58 by hmeij07