Name: Jianmin Wang
Type: User
Company: Yonsei University
Bio: Drug Design , Linux enthusiast , Medicinal_Chemistry_&_ Synthesis , Chemoinformatics , Data Science, Python and C/C++ programmer，Bioinformatics，Deep Learning，AI
Twitter: Jianmin4drugai
Location: **(China)
Blog: https://jianmin2drugai.github.io/
Jianmin Wang's Projects
A novel, template-free approach for the single-step retrosynthesis task.
A multiple-layer inter-molecular contact features based deep neural network for protein-ligand binding affinity prediction
Open Babel is a chemical toolbox designed to speak the many languages of chemical data.
A Python library for structural cheminformatics
OpenChem: Deep Learning toolkit for Computational Chemistry and Drug Design Research
Supermodule containing submodules and external project to build all components
Open source Java-based chemistry library
M. Beyeler (2017). Machine Learning for OpenCV: Intelligent image processing with Python. Packt Publishing Ltd., ISBN 978-178398028-4.
OpenCV-Python图像处理教程
OpenDiscovery
Open Drug Metabolism & PharmacoKinetics (OpenDMPK) is an open source data resource and toolkit for predicting drug metabolism and pharmacokinetic properties of drug molecules.
Render molecules using OpenGL
OpenMM is a toolkit for molecular simulation using high performance GPU code.
OpenMM tutorial for the MSBS course
A batteries-included toolkit for the GPU-accelerated OpenMM molecular simulation engine.
Django based chemical database/inventory
Open Source Neural Machine Translation in PyTorch
A bioinformatics API and web-app to integrate multi-omics datasets & interface with public databases.
A PyTorch framework for prediction of tertiary protein structure
Catalog of Open Source Molecular Modeling Projects
FREE university courses in ML from Top Universities in CS
Free and open-source application (command line and GUI) providing QSAR models predictions as well as applicability domain and accuracy assessment for physicochemical properties, environmental fate and toxicological endpoints. ==================>Download the latest compiled version from the "releases" tab and run the executable installer.
Project for integration of OPS and the Knime workflow engine
Open Parser for Systematic IUPAC Nomenclature. Chemical name to structure conversion
Optimization of binding affinities in chemical space for drug discovery
Workflow for LC-MS feature analysis and spatial mapping
A Toolbox for Post-Processing Quantum Chemical Wavefunction Data
Objective-Reinforced Generative Adversarial Networks (ORGAN) for Sequence Generation Models
organic chemistry reaction prediction using NMT with Attention
React
Typescript
Django
Laravel
Facebook
Microsoft
Google
Alibaba
D3
Tencent