chrinide Goto Github PK
Name: Chrinide
Type: User
Bio: [email protected]
Name: Chrinide
Type: User
Bio: [email protected]
MGmol is a scalable O(N) First-Principles Molecular Dynamics code that is capable of performing large-scale electronics structure calculations and molecular dynamics simulations of atomistic systems.
MILK: Machine Learning Toolkit
Molecular Fragmentation Code
Use bisection search to find a valid rc_core for La/Ce
An assortment of different ideas I've had at one time or another!
Missing data visualization module for Python.
Machine learning tools in JavaScript
Machine learning boiler plate to get you started in minutes (graphlab + sframe + jupyter + docker)
mlens – a library for ensemble learning
Development repo for mlens
Open source platform for the machine learning lifecycle
Machine Learning Interpretability Resources
Code for the Metric Learning for Kernel Ridge Regression algorithm
A python implementation of a simple Multi-Layer Perceptron Neural Network, using the vector representation.
A library of extension and helper modules for Python's data analysis and machine learning libraries.
Max-margin DeepWalk
Modin: Speed up your Pandas workflows by changing a single line of code
A collection of input geometries used in https://doi.org/10.26434/chemrxiv.13626083.v1
Mol2vec - an unsupervised machine learning approach to learn vector representations of molecular substructures
MolCalc is a web interface that allows anyone to build molecules and calculate molecular properties online
Molden2AIM is a utility program which can be used to create AIM-WFN, AIM-WFX, and NBO-47 files from a Molden file.
molden to Casino input converter
Python script to create a web app with Dash to visualize molecular data and molecular geometries
code for single-ended and double-ended molecular GSM
Calculate Root-mean-square deviation (RMSD) of two molecules, using rotation, in xyz or pdb format
MoleView: A Fast and lightweight plug-in for 3D molecular visualization
Program for Molecular Fock Dirac calculations
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.