HPC Cluster Software Resources

Application Name	Module Command	Application Website/Docs	Notes
Amber	module add amber	http://ambermd.org/Manuals.php	Amber is a suite of biomolecular simulation programs
Athena	module add athena	https://princetonuniversity.github.io/Athena-Cversion/	Athena is a grid-based code for astrophysical magnetohydrodynamics (MHD)
Athena++	module add athena++	https://princetonuniversity.github.io/athena/	Athena++ is a complete re-write of the Athena astrophysical magnetohydrodynamics (MHD) code in C++
Blast+	module add blast+	https://www.ncbi.nlm.nih.gov/books/NBK279690/	Basic Local Alignment Search Tool
Cassandra	module add cassandra	https://cassandra.nd.edu/index.php/documentation	Cassandra is an open source Monte Carlo package
cuda/8.0 cuda/9.2 cuda/10.0	module add cuda module add cuda/8.0 module add cuda/9.2 module add cuda/10.0	https://docs.nvidia.com/cuda/	Default is CUDA 9.2 if using module add cuda
cuDNN	module add cudnn	https://docs.nvidia.com/deeplearning/sdk/cudnn-developer-guide/index.html	-
ELSA Tutorial	module add elsa-tutorial	TBA	Used with ELSA SLURM tutorial
ESPResSo	module add espresso	http://espressomd.org/wordpress/documentation/	Extensible Simulation Package for Research on Soft Matter
FASTX-Toolkit	module add fastx	http://hannonlab.cshl.edu/fastx_toolkit/commandline.html	FASTQ/A short-reads pre-processing tools
FFmpeg	module add ffmpeg	https://ffmpeg.org/ffmpeg.html	ffmpeg is a very fast video and audio converter
Garli	module add garli	Website no longer accessible	Genetic Algorithm for Rapid Likelihood Inference
Gaussian	module add gaussian	http://gaussian.com/man/	Electronic structure modeling
GNUplot	module add gnuplot	http://www.gnuplot.info/documentation.html	Portable command-line driven graphing utility
Go	module add go	https://golang.org/doc/	Go programming language
Gromacs	module add gromacs module add gromacs+plumed	http://manual.gromacs.org/documentation/ https://www.plumed.org/doc-master/user-doc/html/index.html	Versatile package to perform molecular dynamics
Hoomd-Blue	module add hoomd-blue	https://hoomd-blue.readthedocs.io/en/stable/	General purpose particle simulation toolkit
JDK	module add jdk	-	Java. Note: OpenJDK is recommended over this version (Oracle Java) due to licensing issues. OpenJDK is installed in the OS by default so no module is needed.
Jellyfish	module add jellyfish	http://www.genome.umd.edu/docs/JellyfishUserGuide.pdf	Fast, parallel k-mer counting for DNA
Julia	module add julia	https://docs.julialang.org/en/v1/	Julia programming language
LAMMPS	module add lammps	https://lammps.sandia.gov/doc/Manual.html	Molecular dynamics simulator
Mathematica	module add mathematica	Example	Example
Matlab	module add matlab	Example	Example
MOPAC	module add mopac	Example	General-purpose semiempirical molecular orbital package
MPMC	module add mpmc	Example	Example
MrBayes	module add mrbayes	Example	Example
NetPBM	module add netpbm	Example	Example
NWChem	module add nwchem module add nwchem-cuda	Example	Example
Omnia	module add omnia	Example	Example
ParaView	module add paraview	Example	Example
pNetCDF	module add pnetcdf	Example	Example
PrinSEQ	module add prinseq	Example	Example
Python	module add python	Example	Example
R	module add R	Example	Example
RStudio	module add rstudio_singularity	Example	Example
SageMath	module add sagemath	Example	Example
SAS	module add sas	Example	Example
SOAPDenovo2	module add soapdenovo2	Example	Example
Sondovac	module add sondovac	Example	Example
SOP	module add sop-gpu	Example	Example
Spades	module add spades	Example	Example
Swift	module add swift	Example	Example
Transcriptomics	module add transcriptomics	Example	Example
Trimmomatic	module add trimmomatic	Example	Example
Trinity	module add trinity	Example	Example
VisIt	module add visit	Example	Example
VMD	module add vmd	Example	Example