Changes to HPC systems are listed below, optionally filtered by system.
HPC Changelog
HPC Changelog
LAMMPS 29Oct20 is available
LAMMPS stable version 29Oct20 has been installed with MVAPICH2, OpenMPI, and IntelMPI on Owens and Pitzer. These are GPU enabled installations. Usage is via the module lammps/29Oct20. For installation details, such as, available packages and example batch scripts, use command: "module help lammps/29Oct20". For help loading an installation, use command: "module spider lammps/29Oct20".
Amber 20 is updated
Amber version 20 has been updated and installed with Intel and GNU compilers and MVAPICH2 on Owens and Pitzer. These include Amber and AmberTools. Usage is via the module amber/20. For installation details, such as, available packages and example batch scripts, use command: "module help amber/20". For help loading an installation, use command: "module spider amber/20".
pnetcdf 1.12.1 available on Pitzer
pnetcdf 1.12.1 is available on Pitzer.
module load pnetcdf/1.12.1
HTSlib 1.11 available on Pitzer
HTSlib 1.11 is available on Pitzer; usage via module load htslib/1.11
.
HISAT2 2.1.0 available on Pitzer
HISAT2 2.1.0 is available on Pitzer; usage via module load hisat2/2.1.0
.