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Jeanette Sperhac's Projects

cybertraining-qchem-ws icon cybertraining-qchem-ws

Installation files for NSF cybertraining grant requirements. Installation target is vidia gateway.

docker-presto icon docker-presto

A base docker container for PRESTO, including dependencies and environment, for single-node use or conversion to Singularity

hsws icon hsws

CCR High School Workshop

lakeeffect-cli icon lakeeffect-cli

This docker image is specifically for use on the UB CCR LakeEffect Cloud.

molecool icon molecool

Example repository for molSSI best practices workshop at UB 2020-01

titan2d-docker icon titan2d-docker

Dockerfiles suitable for running the titan2d tool, either on the command line ('simple') or using the GUI

ubmdi icon ubmdi

Dashboard for MDI at the University at Buffalo

xdmod icon xdmod

An open framework for collecting and analyzing HPC metrics.

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