People

Deborah Penchoff

University of Tennessee - Knoxville

Programs

Campus Champions

Skills

ai deep-learning machine-learning neural-networks reinforcement-learning supervised-learning unsupervised-learning big-data computer-graphics data-analysis dft plotting visualization data-management data-sharing github github-pages benchmarking checkpoint cpu-bound memory parallelization performance-tuning scaling fluid-dynamics gaussian molecular-dynamics openfoam pytorch tensorflow cluster cluster-management cpu-architecture distributed-computing gpu hardware hpc-cluster-architecture hpc-operations lustre networking nvidia unix-environment bash environment-modules git ssh vim vm ACCESS ACCESS-account adding-users allocation-management allocation-time allocation-users anvil bridges-2 stampede2 stampede3 abstract affiliations citation community-outreach management mentorship professional-development project-management proposal-development publication-database research-facilitation research-grants training workforce-development xsede c++fortran jupyterhub mathematica matlab mpi openmp openmpi programming python r spark batch-jobs core-hours job-accounting job-submission pbs slurm biology computational-chemistry data-science quantum-mechanics data-compliance duo vpn spack version-control profile proposal-request

Lisa Perez photo

Lisa Perez

Texas A&M University

Director, High Performance Research Computing

Programs

SWEETER

Skills

computational-chemistry gaussian molecular-dynamics quantum-mechanics training

Paul Rulis

University of Missouri-Kansas City

Associate Professor of Physics

Programs

Campus Champions

Skills

dft machine-learning monte-carlo neural-networks vectorization parameter-sweeps random-numbers github metadata sftp storage core-dump cpu-bound debugging memory optimization parallelization performance-tuning profiling scaling scripting tuning checkpoint lammps molecular-dynamics paraview pytorch tensorflow materials-science quantum-mechanics comet gpu unix-environment batch-jobs core-hours job-accounting job-submission job-sizing pending-jobs schedulers scheduling slurm bash environment-modules git ssh tcp vim x11 permissions modules os proposal-development project-management research-grants software-carpentry xsede c c++conda fortran java programming openmp mpi programming-best-practices python sql putty encryption vpn terminal-emulation-and-window-management library-paths spack software-installation version-control singularity ai data-analysis computational-chemistry resources abstract affiliations citation xml dependencies

Rutgers University-Camden

Programs

CAREERS

Skills

management workforce-development project-management professional-development molecular-dynamics python

Grant Scott

University of Missouri

Director, Data Science and Analytics & Assistant Professor EECS

Programs

Great Plains

Skills

Sebastian Sensale

Sebastian Sensale

Cleveland State University

Programs

Campus Champions

Skills

molecular-dynamics namd amber lammps matlab python expanse bridges-2 stampede2 bash

Nannan Shan

Purdue University

Senior Computational Scientist

Programs

CCMNet, ACCESS CSSN

Skills

CUNY School of Professional Studies

Programs

CAREERS

Skills

George Mason University

Programs

ACCESS CSSN, CCMNet, Campus Champions

Skills

Juan Vanegas

Oregon State University

Programs

Northeast

Skills

bash batch-jobs bioinformatics compiling conda environment-modules hpc-cluster-build hpc-operations jupyterhub molecular-dynamics nfs pip python slurm ssh storage x11 mpi