Ecosyste.ms: Papers
An open API service providing mapping between scientific papers and software projects that are mentioned in them.
All mentions data is based on the CZI Software Mentions dataset.
Papers: 10.1186/s13321-019-0381-4
https://doi.org/10.1186/s13321-019-0381-4
Machine learning models for hydrogen bond donor and acceptor strengths using large and diverse training data generated by first-principles interaction free energies
Cited by: 16
Author(s): Christoph Bauer, Gisbert Schneider, Andreas H. Göller
Published: about 5 years ago
Software Mentions 2
pypi: rdkit
A collection of chemoinformatics and machine-learning software written in C++ and PythonPapers that mentioned: 27
pypi: scikit-learn
A set of python modules for machine learning and data miningPapers that mentioned: 2,431