Knowledge Base Resources
These resources have been contributed and “vetted” by the community of cyberinfrastructure professionals (researchers, research computing facilitators, research software engineers and HPC system administrators) that are participating in programs such as this one, that are supported by the ConnectCI community management platform. Additional Knowledge Base Resources are always welcome!
DeepChem
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DeepChem is an open-source library built on TensorFlow and PyTorch. It is helpful in applying machine learning algorithms to molecular data.
Numpy - a Python Library
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Numpy is a python package that leverages types and compiled C code to make many math operations in Python efficient. It is especially useful for matrix manipulation and operations.
GPU Computing Workshop Series for the Earth Science Community
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GPU training series for scientists, software engineers, and students, with emphasis on Earth science applications.
The content of this course is coordinated with the 6 month series of GPU Training sessions starting in Februrary 2022. The NVIDIA High Performance Computing Software Development Kit (NVHPC SDK) and CUDA Toolkit will be the primary software requirements for this training which will be already available on NCAR's HPC clusters as modules you may load. This software is free to download from NVIDIA by navigating to the NVHPC SDK Current Release Downloads page and the CUDA Toolkit downloads page. Any provided code is written specifically to build and run on NCAR's Casper HPC system but may be adapted to other systems or personal machines. Material will be updated as appropriate for the future deployment of NCAR's Derecho cluster and as technology progresses.