general-synthesis Goto Github PK

aizynthfinder

A tool for retrosynthetic planning

cogvideo

Text-to-video generation.

confgf

Implementation of Learning Gradient Fields for Molecular Conformation Generation (ICML 2021).

coot-videotext

COOT: Cooperative Hierarchical Transformer for Video-Text Representation Learning

disco_diffusion_local

Getting the latest versions of Disco Diffusion to work locally, instead of colab. Including how I run this on Windows, despite some Linux only dependencies ;)

gnn_for_ehr

Code for "Graph Neural Network on Electronic Health Records for Predicting Alzheimer’s Disease"

graphvite

GraphVite: A General and High-performance Graph Embedding System

knowledgegraphembedding

naturecomm_cscg

nbfnet

Official implementation of Neural Bellman-Ford Networks (NeurIPS 2021)

project-azua

Data Efficient Decision Making

ray_tutorial

An introductory tutorial about leveraging Ray core features for distributed patterns.

real-time-voice-cloning-spanish

Clone a voice in 5 seconds to generate arbitrary speech in real-time

route-distances

Tools and routines to calculate distances between synthesis routes and to cluster them.

ru-dalle

Generate images from texts. In Russian

rudalle-aspect-ratio

rxn4chemistry

Python wrapper for the IBM RXN for Chemistry API

rxnmapper

RXNMapper: Unsupervised attention-guided atom-mapping. Code complementing our Science Advances publication on "Extraction of organic chemistry grammar from unsupervised learning of chemical reactions" (https://advances.sciencemag.org/content/7/15/eabe4166).

syba

torchdrug

A powerful and flexible machine learning platform for drug discovery

torchdyn

A PyTorch library entirely dedicated to neural differential equations, implicit models and related numerical methods

xtec

X-RAY diffraction data analysis

xyz2graph

Convert an xyz file into a molecular graph and create a 3D visualisation of the graph.