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  • Displaying 12 results
    KTH Royal Institute of Technology
    GROMACS
    GROMACS is a popular molecular dynamics application used to simulate proteins and lipids.
      Container
      Open Source
      rapidsai/rapidsai
      The RAPIDS suite of software libraries gives you the freedom to execute end-to-end data science and analytics pipelines entirely on GPUs.
      Container
      Sandia National Lab
      LAMMPS
      Large-scale Atomic/Molecular Massively Parallel Simulator (LAMMPS) is a software application designed for molecular dynamics simulations.
        Container
        Open Source
        Relion
        RELION implements an empirical Bayesian approach for analysis of electron cryo-microscopy.
          Container
          Folding@home
          Folding@home
          Folding@home is a distributed computing project for simulating protein dynamics, including the process of protein folding and the movements of proteins implicated in a variety of diseases. It brings together citizen scientists who volunteer to run simulations of protein dynamics on their computers. Insights from this data are helping scientists to better understand biology, and providing new opportunities for developing therapeutics.
            Container
            The Glotzer Group
            HOOMD-blue
            HOOMD-blue is a highly flexible and scalable particle simulation toolkit. It makes use of high-level Python scripts to set initial conditions, control simulation parameters, and extract data for in situ analysis.
              Container
              NVIDIA
              Fine-Tuning COVID-19 CT Scan Classifier
              Example Jupyter Notebook Sample Code to Fine-Tune Clara Train COVID-19 CT Scan Classification Pretrained Model with Custom Dataset
              Resource
              NVIDIA
              AzureML Quick Launch: Clara COVID-19 CT Scan Classifier
              Download pre-configured setup files to launch and fine-tune the Clara Train COVID-19 CT Scan Classification model on AzureML using the NGC-AzureML Quick Launch Toolkit
              Resource
              IBM Corporation
              IBM Visual Insights
              IBM Visual Insights makes computer vision with deep learning more accessible to business users. The software includes an intuitive toolset that empowers subject matter experts to label, train, and deploy deep learning.
              Helm Chart
              Collection
              NVIDIA
              Clara Discovery
              Clara Discovery is a collection of frameworks, applications, and AI models enabling GPU-accelerated computational drug discovery
              Collection
              NVIDIA
              Clara NLP
              Clara NLP is a collection of SOTA biomedical pre-trained language models as well as highly optimized pipelines for training NLP models on biomedical and clinical text
              Collection
              NVIDIA
              Clara Parabricks
              Clara Parabricks is a collection of software tools and notebooks for next generation sequencing, including short- and long-read applications. These tools are designed to be scalable, generating highly accurate results in an accelerated compute environmen

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