erikzhang-9762 Goto Github PK
Name: ZhangLiChuan
Type: User
Bio: Drug design and Deep learning.
Name: ZhangLiChuan
Type: User
Bio: Drug design and Deep learning.
forked from labmlai / annotated_deep_learning_paper_implementations
AI与数据科学各类工具库速查表与参考代码
A curated list of Cheminformatics libraries and software.
ChEMBL database structure pipelines
Official Python client for accessing ChEMBL API.
《动手学深度学习》:面向中文读者、能运行、可讨论。中英文版被60多个国家的400多所大学用于教学。
An exploration strategy improves the diversity of de novo drug design using deep reinforcement learning
A Graph-Convolutional Deep Neural Network for predicting electrostatic potential surfaces
A comprehensive toolkit for predicting free energies
Generative Tensorial Reinforcement Learning (GENTRL) model
Molecular Sets (MOSES): A Benchmarking Platform for Molecular Generation Models
OCE is the first infinitely composable library for reproducibly implementing SOTA molecular property prediction/QSAR techniques.
First steps of an open library to work with pharmacophoric points and pharmacophores.
A hyperparameter optimization framework
Protein-Ligand Interaction Profiler - Analyze and visualize non-covalent protein-ligand interactions in PDB files according to 📝 Adasme et al. (2021), https://doi.org/10.1093/nar/gkab294
Practical Cheminformatics Tutorials
PyMod 3 - sequence similarity searches, multiple sequence/structure alignments, and homology modeling within PyMOL.
Python - 100天从新手到大师
《Pytorch模型训练实用教程》中配套代码
This package contains deep learning models and related scripts for RoseTTAFold
Genetic Algorithm, Particle Swarm Optimization, Simulated Annealing, Ant Colony Optimization Algorithm,Immune Algorithm, Artificial Fish Swarm Algorithm, Differential Evolution and TSP(Traveling salesman)
A small, highly performant JavaScript component for parsing and drawing SMILES strings. Released under the MIT license.
This is a repository, originally inspired by https://github.com/pb3lab/ibm3202, for the practicals of the MBB/QB course of Structural Bioinformatics at the University of Milano
TeachOpenCADD: a teaching platform for computer-aided drug design (CADD) using open source packages and data
一本系统地教你将深度学习模型的性能最大化的战术手册。
A bunch of utility scripts for VMD
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.