Skip to main content
ContainersNVIDIADeepSeek-R1NVIDIALlama-3.1-Nemotron-70B-InstructNVIDIAPyTorch
CollectionsNVIDIAOmniverse Kit (FB)NVIDIADeepStream SDKNVIDIAOmniverse Kit App Streaming
ModelsNVIDIAStyleGAN3 pretrained modelsNVIDIAPeopleNetNVIDIATrafficCamNet
ResourcesNVIDIARiva Skills Quick Start
Helm ChartsNVIDIAGPU OperatorNVIDIANVIDIA NIM Operator

Search

Search thousands of GPU-optimized Containers, pretrained Models, SDKs, and Helm charts—ready to accelerate AI, digital twins, and HPC from cloud to edge.
Accelerate custom generative AI app deployment using pre-built containers with optimized AI models.

Displaying 19 results

NVIDIA HPC-Benchmarks
NVIDIA
The NVIDIA HPC-Benchmarks collection provides four accelerated HPC benchmarks: HPL-NVIDIA, HPL-MxP-NVIDIA, HPCG-NVIDIA, and STREAM.
Container
Relion
Open Source
RELION implements an empirical Bayesian approach for analysis of electron cryo-microscopy.
Container
Quantum ESPRESSO
SISSA
Quantum ESPRESSO is an integrated suite of Open-Source computer codes for electronic-structure calculations and materials modeling at the nanoscale based on density-functional theory, plane waves, and pseudopotentials.
Container
GAMESS
Gordon Group
GAMESS is used for computational chemistry calculations including DFT which is used to understand the potential of a drug molecule binding with proteins for drug discovery.
Container
CHROMA
Jefferson Lab
CHROMA is a Physics application designed for solving the theory of quarks and gluons.
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
MELD
Justin MacCallum, Alberto Perez, and Ken Dill
MELD is a tool for inferring the structure of biomolecules from sparse, ambiguous, or noisy data. MELD combines semi-reliable data with atomistic physical models using Bayesian inference.
Container
ParaView
NVIDIA
ParaView is one of the most popular visualization software for analyzing HPC datasets.
Container
Tinker-HP
Tinker Tools
Tinker-HP is a CPUs and GPUs based, multi-precision, MPI massively parallel package dedicated to long polarizable molecular dynamics simulations and to polarizable QM/MM.
Container
OpenACC Training Materials
NVIDIA, OpenACC.org, UDEL
These training materials have been developed as a collaboration between the University of Delaware and NVIDIA Corporation and are provided free of charge by OpenACC.org.
Container
LBPM
Open Porous Media Initiative
LBPM is an open source software framework designed to model flow processes based on digital rock physics
Container
BigDFT
CEA INAC
BigDFT is a DFT massively parallel electronic structure code using a wavelet basis set with the capability to use a linear scaling method.
Container
HOOMD-blue
The Glotzer Group
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
TorchANI
Roitberg group
TorchANI is a PyTorch implementation of ANI and contains classes like AEVComputer, ANIModel, and EnergyShifter that can be pipelined to compute molecular energies from the 3D coordinates of molecules
Container
Lattice Microbes
UIUC
Lattice Microbes is a QC software package for efficiently sampling trajectories from the chemical reaction in bacteria.
Container
PIConGPU
HZDR
PIConGPU is a plasma physics application to solve the dynamics of a plasma by computing the motion of electrons and ions in the plasma field.
Container
kipoi
Kipoi
Kipoi (pronounce: kípi; from the Greek κήποι: gardens) is an API and a repository of ready-to-use trained models for genomics. It currently contains 2131 different models, covering canonical predictive tasks in transcriptional and post-transcriptional gene regulation. Kipoi's API is implemented as a python package (github.com/kipoi/kipoi) and it is also accessible from the command line or R.
Container
Microvolution
Microvolution
Microvolution is a high-performance 3D deconvolution application, designed to deconvolve images from widefield, confocal, two photon, light sheet, and HCA microscopes, as well as perform blind deconvolution to ameliorate noise in other data types such as deep-tissue images.
Container
CANDLE
Open Source
The CANDLE project is focused on facilitating cancer research with deep learning. The CANDLE software allows deep learning workflows to be deployed at large scale supercomputers.
Container
1-19 of 19 items

Modal Content

NVIDIA uses cookies to improve your experience on our web site. We and our third-party partners also use cookies and other tools to collect and record information you provide as well as information about your interactions with our websites for performance improvement, analytics, and to assist in marketing efforts. By clicking "Accept All", you consent to our use of cookies and other tools as described in our Cookie Policy. You can manage your cookie settings by clicking on "Manage Settings." By continuing to use this site or by clicking one of the buttons below, you agree to our Terms of Service (which contains important waivers). Please see our Privacy Policy for more information on our privacy practices.

Manage Settings