Architecture: x86_64
Operating System: CENTOS 7.5-1804
Cluster scheduler: SLURM 18.08.02
Parallel libraries: OpenMPI 3.1.2 and PMIx 3.0.2




Packages installed
Package Version Description Install
Abaqus 6.1.4 Engineering simulation software software/abaqus-6.14
AnsysEM 19.2 Electromagnetic /opt/exp_soft/ansys_inc/AnsysEM19.2
AnsysFluent 19.2 CFD package /opt/exp_soft/ansys_inc/v192
AnsysFluent 19.1 CFD package /opt/exp_soft/ansys_inc/v191
AnsysFluent 15.7 CFD package /opt/exp_soft/ansys_inc/v150
cmake 3.12.4 software packaging and building tools module load tools/cmake-3.12.4
ESyS-Particle 3.0b Particle-based numerical modelling module load software/ESyS-Particle-3.0b
ESyS-Particle 2.3.5 Particle-based numerical modelling module load software/ESyS-Particle-2.3.5
fftw 3.3.8 Fast Fourier Transform library module load tools/fftw-3.3.8
Gaussian 9.0 General purpose computational chemistry software module load software/gaussian-09
gcc 8.2.0 Gnu compiler - C and Fortran module load compilers/gcc820
HyPhy 2.3.12 Hypothesis testing using Phylogenies module load software/HyPhy-2.3.12
HyPhy 2.3.14 Beta Hypothesis testing using Phylogenies module load software/HyPhy-2.3.14B
ls-dyna 10.1.0 Finite element simulation module load software/ls-dyna-10.1.0
ls-dyna 8.1.0 Finite element simulation module load software/ls-dyna-8.1.0
mpich 3.3 Message Passing Interface for parallel software module load mpi/mpich-3.3
Monolix 2018R2 Mixed effects modeling for pharmacometrics Pharmacology group only
NAMD 2.13 Molecular dynamics simulation package module load software/NAMD-2.13-CUDA
NAMD 2.12 Molecular dynamics simulation package module load software/NAMD-2.12-CUDA
Octave 4.4.1 High-level interpreted language for numerical computations module load software/octave-4.4.1
OpenMPI 3.1.2 Message Passing Interface for parallel software module load mpi/openmpi-3.1.2
OpenMPI 1.10.7 Message Passing Interface for parallel software module load mpi/openmpi-1.10.7
OpenMPI 1.8.3 Message Passing Interface for parallel software module load mpi/openmpi-1.8.3
paml 4.9h Phylogenetic analyses of DNA or protein sequences module load software/paml-4.9h
perl 5.28.0 Perl scripting language module load compilers/perl-5.28
perl 5.16.3 Perl scripting language all nodes
Python 2.7.14 Anaconda version of python module load python/anaconda-python-2.7
R 3.5.1 Statistical computing and graphics module load software/R-3.5.1
RAxML 8.2 Maximum Likelihood based inference of large phylogenetic trees module load software/RAxML-8.2
Singularity 3.0.1 Containerization environment All worker nodes
Stata 13 Statistics Graphics and Data Management module load software/stata-13
VMD 1.9.3 Visual Molecular Dynamics module load software/vmd-1.9.3