Changes to HPC systems are listed below, optionally filtered by system.
HPC Changelog
HPC Changelog
Q-Chem 5.1 is available
Date:
Monday, August 20, 2018 - 12:45pm
System(s):
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.
Julia 1.0.0 available on Owens
Date:
Wednesday, August 15, 2018 - 12:00pm
System(s):
Usage is "module load julia/1.0.0". This version also works with Jupyter notebooks.
Gromacs 2018.2 now available on Owens
Date:
Tuesday, August 14, 2018 - 3:30pm
System(s):
Gromacs 2018.2 has been installed on Owens; usage is via the module gromacs/2018.2.
Ansys 19.1 available on Owens
Date:
Wednesday, July 18, 2018 - 3:00pm
System(s):
Ansys 19.1 is now available on Owens. Load with "module load ansys/19.1"
Blast Database update
Date:
Tuesday, July 17, 2018 - 12:00pm
System(s):
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 now available on Owens
Date:
Friday, July 6, 2018 - 1:45pm
System(s):
cmake 3.11.4 is installed on Owens
module load cmake/3.11.4
Star-fusion 1.4.0 installed on Owens
Date:
Wednesday, June 27, 2018 - 8:30am
System(s):
Star-fusion 1.4.0 installed on Owens.
Turbomole 7.2.1 installed on Owens
Date:
Thursday, June 7, 2018 - 12:30pm
System(s):
Turbomole 7.2.1 is available on Owens.
module load turbomole/7.2.1
SRA Toolkit 2.9.0 installed on Owens
Date:
Wednesday, June 6, 2018 - 3:45pm
System(s):
SRA Toolkit 2.9.0 is now installed on Owens. Load with "module load sratoolkit/2.9.0"
R/3.5.0 is now available on Owens
Date:
Thursday, May 17, 2018 - 1:30pm
System(s):
