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Name: Jaroslaw Granda
Type: User
Name: Jaroslaw Granda
Type: User
automated reaction profile generation
Python core of avatar²
Molecule Design using Monte Carlo Tree Search with Neural Rollout
Data for our paper "Chemical Reaction Practicality Judgment via Deep Symbol Artificial Intelligence"
Deep Drug Coder: A TensorFlow2.0 heteroencoder for molecular encoding and de novo generation
This repository contains implementations and illustrative code to accompany DeepMind publications
Fréchet ChemNet Distance: A quality measure for generative models for molecules
Implementation of Graph Convolutional Networks in TensorFlow
Generative Tensorial Reinforcement Learning (GENTRL) model
Code for "Molecule Edit Graph Attention Network: Modeling Chemical Reactions as Sequences of Graph Edits"
Shows some of the ways molecule generation and optimization can go wrong
A Python package for calculating molecular features
Predicting Organic Reaction Outcomes with Weisfeiler-Lehman Network (NIPS 2017)
PGPortfolio: Policy Gradient Portfolio, the source code of "A Deep Reinforcement Learning Framework for the Financial Portfolio Management Problem"(https://arxiv.org/pdf/1706.10059.pdf).
Predicting reaction performance using machine learning
The implementation of Temporal Generative Adversarial Nets with Singular Value Clipping
Generate 3D transition state geometries with GNNs
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.