Stars
A series of Jupyter notebooks that walk you through the fundamentals of Machine Learning and Deep Learning in Python using Scikit-Learn, Keras and TensorFlow 2.
简单粗暴 TensorFlow 2 | A Concise Handbook of TensorFlow 2 | 一本简明的 TensorFlow 2 入门指导教程
Therapeutics Commons (TDC-2): Multimodal Foundation for Therapeutic Science
Practical Cheminformatics Tutorials
tensorflow学习笔记,来源于电子书:《Tensorflow实战Google深度学习框架》
Example code from the book "Deep Learning for the Life Sciences"
Tensorflow 2.0 Notes 提供了TF2.0案例实战以及TF2.0基础实战,目标是帮助那些希望和使用Tensorflow 2.0进行深度学习开发和研究的朋友快速入门,其中包含的Tensorflow 2.0教程基本通过测试保证可以成功运行(有问题的可以提issue,笔记网站正在建设中)。
Tutorials for deep learning course here:
Wrapper for RDKit's RunReactants to improve stereochemistry handling
Novel molecules from a reference shape!
Tools and scripts I wrote and regularly use
Practical Cheminformatics Blog Posts
Materials for my presentation on molecular standardization as part of the RSC OpenScience workshop series
Implementation of regular and multiscale parametric t-SNE in pytorch
Materials from the Intro to the RDKit tutorial at AIDD 2021