neallyu's Stars
Jacks0nJ/PyFPT
Stochastic first-passage time (FPT) simulations using importance sampling.
Visualize-ML/Book3_Elements-of-Mathematics
Book_3_《数学要素》 | 鸢尾花书:从加减乘除到机器学习;上架;欢迎继续纠错,纠错多的同学还会有赠书!
mnhrdt/imscript
a collection of small and standalone utilities for image processing, written in C
oshino29/ngaArchive
nga论坛帖子的存档
simongravelle/lammps-input-files
LAMMPS inputs and data files
ventoy/Ventoy
A new bootable USB solution.
microsoft/IoT-For-Beginners
12 Weeks, 24 Lessons, IoT for All!
microsoft/Web-Dev-For-Beginners
24 Lessons, 12 Weeks, Get Started as a Web Developer
microsoft/ML-For-Beginners
12 weeks, 26 lessons, 52 quizzes, classic Machine Learning for all
TinkerTools/tinker
Tinker: Software Tools for Molecular Design
slidevjs/slidev
Presentation Slides for Developers
henriasv/lammps-logfile
Tool to read a logfile produced by LAMMPS into a simple python data structure with a get()-function providing the log data.
MDAnalysis/mdanalysis
MDAnalysis is a Python library to analyze molecular dynamics simulations.
usnistgov/atomman
Atomistic Manipulation Toolkit
deepmodeling/deepmd-kit
A deep learning package for many-body potential energy representation and molecular dynamics
deepmodeling/dpdata
A Python package for manipulating atomistic data of software in computational science
lammps/pizza
Pizza.py is a loosely integrated collection of tools written in Python, many of which provide pre- and post-processing capability for the LAMMPS molecular dynamics package.
cryos/avogadro
Avogadro 1 is not under active development, the repository was archived in September 2021. Development of Avogadro 2 is being done at https://github.com/openchemistry/avogadrolibs. Avogadro is an advanced molecular editor designed for cross-platform use in computational chemistry, molecular modeling, bioinformatics, materials science, and related areas.
jewettaij/moltemplate
A general cross-platform tool for preparing simulations of molecules and complex molecular assemblies
BluePointLilac/ContextMenuManager
🖱️ 纯粹的Windows右键菜单管理程序
QEF/q-e
Mirror of the Quantum ESPRESSO repository. Please do not post Issues or pull requests here. Use gitlab.com/QEF/q-e instead.
tbepler/topaz
Pipeline for particle picking in cryo-electron microscopy images using convolutional neural networks trained from positive and unlabeled examples. Also featuring micrograph and tomogram denoising with DNNs.
miyakogi/pyppeteer
Headless chrome/chromium automation library (unofficial port of puppeteer)
labuladong/fucking-algorithm
刷算法全靠套路,认准 labuladong 就够了!English version supported! Crack LeetCode, not only how, but also why.
jjhelmus/berryconda
Conda based Python distribution for the Raspberry Pi
voken1/AutoSSR
share FREE shadowsocks(R) servers here
qingshuisiyuan/electron-ssr-backup
electron-ssr原作者删除了这个伟大的项目,故备份了下来,不继续开发,且用且珍惜
dragen1860/Deep-Learning-with-TensorFlow-book
深度学习入门开源书,基于TensorFlow 2.0案例实战。Open source Deep Learning book, based on TensorFlow 2.0 framework.
halfrost/Halfrost-Field
✍🏻 这里是写博客的地方 —— Halfrost-Field 冰霜之地
d2l-ai/d2l-zh
《动手学深度学习》:面向中文读者、能运行、可讨论。中英文版被70多个国家的500多所大学用于教学。