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neuromancer
Pytorch-based framework for solving parametric constrained optimization problems, physics-informed system identification, and parametric model predictive control.HyperNetX
Python package for hypergraph analysis and visualization.safekit
SHAD
Scalable High-performance Algorithms and Data-structuresOpenCGRA
OpenCGRA is an open-source framework for modeling, testing, and evaluating CGRAs.NWGraph
Complete Project Documentationcmaputil
QASMBench
A low-level OpenQASM benchmark suite for NISQ evaluation and simulation. Please see our paper for details.ExaGO
High-performance power grid optimization for stochastic, security-constrained, and multi-period ACOPF problems.isicle
In silico chemical library engine for high-accuracy chemical property predictionDM-Sim
DM-Sim: Quantum Simulator on GPU Cluster using Density Matrixdeps_arXiv2020
Differentiable predictive control (DPC) policy optimization examples.lamellar-runtime
Lamellar is an asynchronous tasking runtime for HPC systems developed in RUSTDHSVM-PNNL
tesp
COMET
soda-opt
deimos
ripples
A C++ Library for Influence Maximizationdarkchem
TCBNN
chemreasoner
ChemReasoner - Catalyst Discovery via Large Language Model-driven Reasoningchgl
Chapel HyperGraph Library (CHGL) - HPC-class Hypergraphs in ChapelSLiCE
Subgraph Based Learning of Contextual Embeddinggmt
Global Memory and Threading runtime systemchissl
Interactive machine learning interfaces-blas
This package includes the implementation for four sparse linear algebra kernels: Sparse-Matrix-Vector-Multiplication (SpMV), Sparse-Triangular-Solve (SpTRSV), Sparse-Matrix-Transposition (SpTrans) and Sparse-Matrix-Matrix-Multiplication (SpMM) for Single-node Multi-GPU (scale-up) platforms such as NVIDIA DGX-1 and DGX-2.MSAC
socialsim
qasmtrans
A C++ based quantum transpiler for NISQ devicescactus
LLM Agent that leverages cheminformatics tools to provide informed responses.torchntk
buildingid
Unique Building Identifier (UBID)mol_dgnn
Molecular Dynamic Graph Neural NetworkDeepDataProfiler
Python library for analyzing the internal structure of deep neural networks.mercat
MerCat: python code for versatile k-mer counting and diversity estimation for database independent property analysis for meta -ome dataleapR
E4D
socialsim_package
DDKS
A high-dimensional Kolmogorov-Smirnov distance for comparing high dimensional distributionsGridSTAGE
slim
Drop-in replacements for PyTorch nn.Linear for stable learning and inductive priors in physics informed machine learning applications.pychip_gui
pyCHIP is a tool for segmentation and feature classification in transmission electron microscopy (TEM) images based on a small support set of user-provided examples.NWQ-Sim
sven
arena
The programming runtime and interfaces for ARENA.fqc
📈 Extensible quality control dashboard built around FASTQ assessment.buildingid-py
Unique Building Identifier (UBID)hundo
💯 Snakemake-based amplicon processing protocol for 16S and ITS sequences.memgaze
SV-Sim
SV-Sim: Scalable PGAS-based State Vector Simulation of Quantum CircuitsNeural-Modules-for-Differential-Algebraic-Equations
rofi
hexwatershed
Flow routing using a hexagonal grid.HiParTI
solubility-prediction-paper
blueprint-styler
Make custom blueprint.css stylescopper
Performance curve generator for building energy simulationhypernetx-widget
building-energy-standards-data
Database of building energy standards data for building energy simulation.eqc
ANIMATE
i2x
Interconnection Innovation e-Xchange (i2x) Test Systemsesteem
psl
GeoCLUSTER
GeoCLUSTER is a Python-based web application that provides a collection of interactive methods for streamlining the visualization of the technical and economic modeling of closed-loop geothermal systems.mcl
grid_prediction
ruleset-checking-tool
ARTS
Abstract RunTime SystemConStrain
ConStrain is a data-driven knowledge-integrated framework that automatically verifies that building system controls function as intended.gparm
A tool for developing parametric inputs for other software.sds
DMIPL
Differentiable Mixed-Integer Programming Layersbrislawn-2018-founders-species
🦠📓 a microbiome paperDPC_for_robotics
AutoMicroED
qFeature
Extract features from time series using moving windows of regression fitsSTOMP-W
Fortran 90 source code, example problems, and output conversion scripts for the STOMP-W simulator.lamellar
Lamellar is an asynchronous tasking runtime for HPC systems developed in RUSTThermalTracker
Active-Sampling-for-Atomistic-Potentials
Active sampling for neural network potentials: Accelerated simulations of shear-induced deformation in Cu–Ni multilayersNWPEsSE
NWHypergraph
nwqbench
nmrfit
Quantitative NMR analysis through least-squares fit of spectroscopy dataLOPO
Learning to Optimize with Proximal Operators (LOPO)DieselWolf
Open source data set for radio frequency machine learning researchpytorch_soo
Second Order Optimizers for Machine Learningpecblocks
Generalized block diagram modeling of power electronic converters for grid solar and storage applications.external_sort
conformer_selection
neural_ODE_ICLR2020
sppsi_cppf
Simulate microstructure evolution using the coupled CP and PF methods for the SPPSI project.rsed
Stream editing in R: Manipulating text files with insertions, replacements, deletions, substitutions, and commentingssass-e
SSASSE software is responsible for validating, and verifying innovative safe scanning methodologies, models, architectures, and prototypes to safely assess operational technology (OT) installed in critical energy infrastructure.oedisi_dopf
OpenEDI - System Integration (OEDI-SI) - PNNL Distributed Optimal Power Flow (DOPF)pakman
PaKman: A Scalable Algorithm for Generating Genomic Contigs on Distributed Memory Machinesrenyiqnets
mass1
Modular Aquatic Simulation System 1D (MASS1)Love Open Source and this site? Check out how you can help us