Computational Resources at the CCH:
-
Getting started:
- Obtaining an account
- Connecting to the account
- Establishing a GUI connection to your account
- Controlling your VNC display
- How to copy files from and to the server
- cch.uleth.ca:
- CPU: dual Epyc 7742 @ 2.9 GHZ system with 128 cores
- GPU: 3 x NVidia GV100GL [Tesla V100S PCIe 32GB]
- RAM: 512 GB
- Storage: 75TB RAID5
- Batch Processing: SLURM
(please read this documentation on how to submit processes to the batch queues for CPU and GPU, as well as for instructions on how to submit interactive jobs to the SLURM queue.) - demeler2.uleth.ca:
- CPU: Intel i7-7820X CPU @ 3.6 GHz system with 16 cores
- RAM: 64 GB
- Storage: 8TB RAID5
- demeler3.uleth.ca:
- CPU: Intel(R) i9-7980XE CPU @ 2.6 GHz system with 36 cores
- RAM: 128 GB
- Storage: 7TB RAID5
- dot
- mpi/mpich-x86_64
- module-git
- module-info
- modules
- null
- use.own
- amber/20 (AmberTools)
- fftw3/double
- fftw3/float
- gromacs/2020.5
- gromacs/2020.5-double
- gromacs/2020.5-mpi
- gromacs/2020.5-plumed
- lammps/double
- lammps/single
- namd/2.14
- namd/3.0
- openmm/7.5.0
- plumed/2.7.0
- pymol/gui
- python/anaconda3
- ultrascan/gui
- ultrascan/gui-build
- ultrascan/mpi
- ultrascan/mpi-build
Detailed Instructions:
CCH Hardware:
CCH software packages:
-
The software on the CCH server is installed using specific software environments
that can be accessed by modules. To find out what software environments can be
invoked through modules issue the 'module avail' command.
The following modules are currently available:
System Software: