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Name: steven
Type: User
Company: leuven
Bio: geek makes life easier
Location: Mars for today
Name: steven
Type: User
Company: leuven
Bio: geek makes life easier
Location: Mars for today
Python tools for automating routine tasks encountered when running quantum chemistry computations.
Atomic Simulation Environment - mirror of https://gitlab.com/ase/ase
Parsers and algorithms for computational chemistry logfiles
ChemDataExtractor 2.1 that has been modified for extracting properties of molecular thermally-activated delayed fluorescent (TADF) materials.
Data science Python notebooks: Deep learning (TensorFlow, Theano, Caffe, Keras), scikit-learn, Kaggle, big data (Spark, Hadoop MapReduce, HDFS), matplotlib, pandas, NumPy, SciPy, Python essentials, AWS, and various command lines.
doped is a Python software for the generation, pre-/post-processing and analysis of defect supercell calculations, implementing the defect simulation workflow in an efficient, reproducible, user-friendly yet powerful and fully-customisable manner.
Band structure unfolding made easy!
Evolutionary Algorithm using Python
Automatically generates FORtran Documentation from comments within the code.
Framework for Molecular Aggregate Excitation
跟我一起写Makefile重制版
KU Leuven R/Markdown, plain Markdown and LaTeX templates
Slides, exercises and extra files for the Linux scripting course at KU Leuven
An interface program of approximate spin-orbit coupling for spin-forbidden reactions involving multiple spin states.
this is a simple demonstration of my first code to accelerate genetic algorithm by using machine learning
Machine learning, in numpy
Combining Psi4 and Numpy for education and development.
Python Materials Genomics (pymatgen) is a robust materials analysis code that defines core object representations for structures and molecules with support for many electronic structure codes. It is currently the core analysis code powering the Materials Project.
Python - 100 days from deft to master
Build your neural network easy and fast
⚛️ A module for solving and visualizing the Schrödinger equation.
Tool for setting up an ORCA calculation using the atom-in-molecule adaptive q-vSZP basis set.
Python Implementation of Reinforcement Learning: An Introduction
Simple Reinforcement learning tutorials
浙江大学课程攻略共享计划
A declarative, efficient, and flexible JavaScript library for building user interfaces.
🖖 Vue.js is a progressive, incrementally-adoptable JavaScript framework for building UI on the web.
TypeScript is a superset of JavaScript that compiles to clean JavaScript output.
An Open Source Machine Learning Framework for Everyone
The Web framework for perfectionists with deadlines.
A PHP framework for web artisans
Bring data to life with SVG, Canvas and HTML. 📊📈🎉
JavaScript (JS) is a lightweight interpreted programming language with first-class functions.
Some thing interesting about web. New door for the world.
A server is a program made to process requests and deliver data to clients.
Machine learning is a way of modeling and interpreting data that allows a piece of software to respond intelligently.
Some thing interesting about visualization, use data art
Some thing interesting about game, make everyone happy.
We are working to build community through open source technology. NB: members must have two-factor auth.
Open source projects and samples from Microsoft.
Google ❤️ Open Source for everyone.
Alibaba Open Source for everyone
Data-Driven Documents codes.
China tencent open source team.