Changes to HPC systems are listed below, optionally filtered by system.
Wine (only support Windows 64-bit binaries) is now available on Owens.
Blast-database/2018-08 is now available.
Q-Chem MPICH-3 and OpenMP version are installed on Owens and Ruby. Usage is via the module qchem/5.1.1 for MPI version and via the module qchem/5.1.1-openmp for OpenMP version.
Usage is "module load julia/1.0.0". This version also works with Jupyter notebooks.
Gromacs 2018.2 has been installed on Owens; usage is via the module gromacs/2018.2.
Ansys 19.1 is now available on Owens. Load with "module load ansys/19.1"
BLAST database can be accessed through the blast-database module with desired versions. Blast module no longer loads BLAST database. User will have to explicitly load the blast-database module with the desired version.
cmake 3.11.4 is installed on Owens
module load cmake/3.11.4
Star-fusion 1.4.0 installed on Owens.
Turbomole 7.2.1 is available on Owens.
module load turbomole/7.2.1