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: 10.1038/s41598-020-72889-5

https://doi.org/10.1038/s41598-020-72889-5

A structure-based computational workflow to predict liability and binding modes of small molecules to hERG

Cited by: 14
Author(s): Subha Kalyaanamoorthy, Shawn M. Lamothe, Xiaoqing Hou, Tae Chul Moon, Harley T. Kurata, Michael Houghton, Khaled Barakat
Published: almost 4 years ago

Software Mentions 2

pypi: 0
0
Papers that mentioned: 1,265
pypi: ParmEd
Inter-package toolkit for molecular mechanical simulations
Papers that mentioned: 23