Relocated Tutorials

Molecule Tutorials - Herong's Tutorial Examples

∟Relocated Tutorials

Provides a list of tutorial notes and example codes that were included in previous versions of this book and are now relocated to other books.

The following tutorial notes and example codes have been moved to "Cheminformatics Tutorials - Herong's Tutorial Examples" at https://www.herongyang.com/Cheminformatics.

"What Is RDKit" - Provides a quick introduction of RDKit, a collection of cheminformatics and machine-learning software written in C++ and Python.
"RDKit Installation Options" - Provides a quick introduction of RDKit installation options on Linux systems. None of them is easy.
"Build RDKit from Source Code on CentOS System" - Provides a tutorial example on how to install RDKit from source code on CentOS Linux systems, using GCC C/C++, make, cmake tools.
"Compile, Link and Run RDKit C++ API Examples" - Provides a tutorial example on how to compile, link and run RDKit C++ API examples provided in the RDKit source package.
"Try RDKit Python API" - Provides a tutorial example on how to use the RDKit Python API. Unfortunately, it is not working because of the missing boost_python library.