Robert Harrison from Brookhaven gave this talk at the MVAPICH User Group. “MADNESS, TESSE/EPEXA, and MolSSI are three quite different large and long-lived projects that provide different perspectives and driving needs for the future of message passing. All three of these projects employ MPI and have a vested interest in computation at all scales, spanning the classroom to future exascale systems.”
Video: The Molecular Sciences Software Institute
May 3, 2017 by
Daniel Crawford from Virginia Tech gave this talk at the HPC User Forum. “The Molecular Sciences Software Institute serves as a nexus for science, education, and cooperation serving the worldwide community of computational molecular scientists – a broad field including of biomolecular simulation, quantum chemistry, and materials science. The Institute will spur significant advances in software infrastructure, education, standards, and best-practices that are needed to enable the molecular science community to open new windows on the next generation of scientific Grand Challenges.”
