The MCCF provides users with accounts on MCCF
- In order to promote the potential of our computational chemistry tools, MCCF personnel will set up accounts for our clients on MCCF servers and workstations.
- Dr. Holley can provide different levels of consultation services depending on the
clientsneeds. The services can range from project initiation to completion, which would be done in close collaboration with clients, to training and consultation for users who wish to carry out their own calculations. Areas of particular expertise include protein homology modeling, ligand docking, and molecular dynamics.
The Extreme Science and Engineering Digital Environment (XSEDE; formerly TeraGrid) offers free high-performance and high-throughput computational resources at NSF-sponsored supercomputer sites. Full researcher allocations are granted through a peer-reviewed merit-based application process (http://www.xsede.org/). The MCCF promotes efforts to utilize the advanced computing power of the NSF sponsored XSEDE. Prospective XSEDE jobs are first evaluated locally for initial algorithm code performance, parameter optimizations and data stream output storage handling using high powered workstation machines.