Pinned Repositories
1D-RMDFT
3D-RISM
3D-RISM-CUDA
3D-RISM-CUDA-MPI
3D-RISM-MPI
3D-RISM-Tinker
3D-RISM on Tinker
allegro
Allegro is an open-source code for building highly scalable and accurate equivariant deep learning interatomic potentials
fundamental-measure-theory-for-hard-disk
A classical density functional theory code for hard disk crystal
otbook
書籍『最適輸送の理論とアルゴリズム』のサポートページです。
pymanopt
Python toolbox for optimization on Riemannian manifolds with support for automatic differentiation
drmaruyama's Repositories
drmaruyama/fundamental-measure-theory-for-hard-disk
A classical density functional theory code for hard disk crystal
drmaruyama/Atif
drmaruyama/bgle
Simulation code for the generalized Langevin equation
drmaruyama/Blueqat
Quantum Computer Library for Everyone
drmaruyama/cdftpy
drmaruyama/centos8-gcc
drmaruyama/deep-learning-from-scratch-2
『ゼロから作る Deep Learning ❷』(O'Reilly Japan, 2018)
drmaruyama/deep-learning-from-scratch-3
『ゼロから作る Deep Learning ❸』(O'Reilly Japan, 2020)
drmaruyama/deep-learning-with-pytorch-ja
deep-learning-with-pytorchの日本語版repositoryです。
drmaruyama/deepFMPOv3D
Implementation of Shape and Electrostatic similarity metric in deepFMPO.
drmaruyama/dionysus
Library for computing persistent homology
drmaruyama/DL_holographicQCD
numerical experiments on https://arxiv.org/abs/1809.10536
drmaruyama/dlwpt-code
Code for the book Deep Learning with PyTorch by Eli Stevens, Luca Antiga, and Thomas Viehmann.
drmaruyama/gcWGAN
Guided Conditional Wasserstein GAN for De Novo Protein Design
drmaruyama/kmol
kMoL is a machine learning library for drug discovery and life sciences, with federated learning capabilities.
drmaruyama/MachineLearning-Book
書籍 AIエンジニアを目指す人のための機械学習入門(清水琢也・小川雄太郎、技術評論社、20/04/13) のサポートリポジトリ
drmaruyama/OpenFermion
OpenFermion: The Electronic Structure Package For Quantum Computers.
drmaruyama/ornstein-zernike
Machine Learning to infer improved closure relationships for the Ornstein-Zernike equation
drmaruyama/PeptideBuilder
drmaruyama/poac
Package manager for C++
drmaruyama/PROFESS
PRinceton Orbital-Free Electronic Structure Software
drmaruyama/PyFMT
An python script implementation to solve Density Functional Theory algorithms
drmaruyama/pyPRISM
A framework for conducting polymer reference interaction site model (PRISM) calculations
drmaruyama/pytorch_tutorials_jp
PyTorch公式チュートリアル(日本語翻訳版)の各ノートブックファイル(Google Colab用)です
drmaruyama/qflex
Flexible Quantum Circuit Simulator (qFlex) implements an efficient tensor network, CPU-based simulator of large quantum circuits.
drmaruyama/qgate
Quntum gate simulator
drmaruyama/qulacs
Variational Quantum Circuit Simulator for Quantum Computation Research
drmaruyama/SALMON
Scientific program for first-principles electron dynamics calculations
drmaruyama/samplemod
drmaruyama/SoftwareDesign_scikit-learn_tutorial
連載『scikit-learnで学ぶ機械学習アルゴリズム』のサポートリポジトリ