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perf-book Public
Forked from dendibakh/perf-bookThe book "Performance Analysis and Tuning on Modern CPU"
TeX Creative Commons Zero v1.0 Universal UpdatedDec 3, 2024 -
kickstart.nvim Public
Forked from nvim-lua/kickstart.nvimA launch point for your personal nvim configuration
Lua MIT License UpdatedNov 21, 2024 -
ChemEx Public
Forked from gbouvignies/ChemExChemEx is an analysis program for chemical exchange detected by NMR.
Python GNU General Public License v3.0 UpdatedNov 20, 2024 -
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writing-a-c-compiler-tests Public
Forked from nlsandler/writing-a-c-compiler-testsTest cases for Writing a C Compiler
C Other UpdatedOct 30, 2024 -
gromacs Public
Forked from gromacs/gromacsPublic/backup repository of the GROMACS molecular simulation toolkit. Please do not mine the metadata blindly; we use https://gitlab.com/gromacs/gromacs for code review and issue tracking.
C++ GNU Lesser General Public License v2.1 UpdatedOct 29, 2024 -
awesome-molecular-generation Public
Forked from amorehead/awesome-molecular-generationAwesome papers related to generative molecular modeling and design.
UpdatedOct 20, 2024 -
DiAMoNDBack Public
Forked from Ferg-Lab/DiAMoNDBackDiAMoNDBack: Diffusion-denoising Autoregressive Model for Non-Deterministic Backmapping of Cα Protein Traces
Python UpdatedOct 20, 2024 -
DiffLinker Public
Forked from igashov/DiffLinkerDiffLinker: Equivariant 3D-Conditional Diffusion Model for Molecular Linker Design
Python MIT License UpdatedOct 20, 2024 -
NVTX_example Public
Forked from chig/NVTX_exampleHow to call NVTX from Fortran
Fortran MIT License UpdatedOct 7, 2024 -
perf-ninja Public
Forked from dendibakh/perf-ninjaThis is an online course where you can learn and master the skill of low-level performance analysis and tuning.
C++ UpdatedSep 23, 2024 -
pmu-tools Public
Forked from andikleen/pmu-toolsIntel PMU profiling tools
Python GNU General Public License v2.0 UpdatedSep 19, 2024 -
benchmark Public
Forked from google/benchmarkA microbenchmark support library
C++ Apache License 2.0 UpdatedSep 13, 2024 -
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A modular framework for neural networks with Euclidean symmetry
Python Other UpdatedAug 25, 2024 -
nn-zero-to-hero Public
Forked from karpathy/nn-zero-to-heroNeural Networks: Zero to Hero
Jupyter Notebook MIT License UpdatedAug 18, 2024 -
MLMM-Potential Public
Forked from RikenSugitaLab/MLMM-PotentialDeveloping Machine Learning Potential for QM/MM
Fortran UpdatedAug 7, 2024 -
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dftbplus Public
Forked from dftbplus/dftbplusDFTB+ general package for performing fast atomistic simulations
Fortran Other UpdatedJul 19, 2024 -
computer_enhance Public
Forked from cmuratori/computer_enhanceSource code for the https://computerenhance.com programming series
C++ Other UpdatedJun 26, 2024 -
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TPC-Barcelona-LLM-Tutorial Public
Forked from ramanathanlab/TPC-Barcelona-LLM-TutorialLarge Language Models (LLMs) for Science and Engineering Applications -- Tutorial given at TPC conference in Barcelona 2024
Jupyter Notebook UpdatedJun 19, 2024 -
cactus Public
Forked from pnnl/cactusLLM Agent that leverages cheminformatics tools to provide informed responses.
Jupyter Notebook BSD 2-Clause "Simplified" License UpdatedJun 19, 2024 -
genesis-2.1.0beta_cgdyn Public
Forked from genesis-release-r-ccs/genesis-2.1.0beta_cgdynGENESIS CGDYN from GENESIS2.1.0
Fortran GNU Lesser General Public License v3.0 UpdatedJun 10, 2024 -
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Awesome-Graph-Research-ICML2024 Public
Forked from azminewasi/Awesome-Graph-Research-ICML2024All graph/GNN papers accepted at the International Conference on Machine Learning (ICML) 2024.
MIT License UpdatedJun 9, 2024