Resource Overview
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Onboarding guide
Access
Accounting
Running jobs
Optimisaion guides
Compatibility guides
Where and how to compile code
Data transfer
ML/AI on Discoverer
Storage
Software
ABINIT
AmberTools (CPU)
Anaconda/Conda
Autoconf
Compilers
Conda (CPU)
Conda (GPU)
CMake
CP2K
Curl
DNN (Deep Neural Network)
FFmpeg
GROMACS (CPU and GPU)
Julia
LAMMPS
Libraries
AMD Optimizing CPU Libraries (AOCL)
BLAS
BLIS
Bzip2
C-blosc
C-blosc2
CBLAS
CGNS
CRTM
FFTW3
Giflib
GNU MP (GMP)
GSL
HDF5
ISL
JasPer
JBIG-KIT
LAPACK
LAPACKE
LERC
Libaec
Libdeflate
Libevent
Libjpeg-turbo
Libmd
LibPNG
LibSSH2
LibTIFF
Libwebp
Libzip
LZ4
LZMA
Math Kernel Library (MKL)
GNU MPC
GNU MPFR
MPI
NCEPLIBS
NetCDF
oneTBB
OpenBLAS
OpenMM
PAPI
PnetCDF
PROJ
PRRTE
QD
QUADPACK
ScaLAPACK
SHTOOLS
Slatec
Snappy
SQLite
SuperLU
SWIG
SZIP
TMGLIB
UCC
UCX
VTK
wannier90
xmlf90
XZ
ZeroMQ
ZFP
Zlib
Zlib-ng
Zstandard/zstd
Lua
NAMD
NWChem
OpenFOAM
ORCA
pmemd.MPI (CPU)
Python
Python virtual environments (GPU)
PyTorch (GPU)
Transformers (Hugging Face) (GPU)
Quantum ESPRESSO
SW4
TensorFlow (GPU)
Text editors
Tinker
UPP
VASP
WRF
WRF-SFIRE (self-support)
SSH Security
Setting your time zone
Acknowledgements
Getting help
Discoverer HPC Docs
Software
Libraries
SZIP
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SZIP
See
Libaec