Published February 9, 2020
| Version v1
Dataset
Open
New Categories of Activity Cliffs
Authors/Creators
- 1. Department of Life Science Informatics, B-IT, LIMES Program Unit Chemical Biology and Medicinal Chemistry, Rheinische Friedrich-Wilhelms-Universität, Endenicher Allee 19c, D-53115 Bonn, Germany.
Description
7465 activity cliffs (ACs) are provided including ACs with two substitution sites (ds-ACs), isomer ACs (iso-ACs), and ACs containing privileged substructures (PS-ACs). See readme.txt for further details.
Files
readme.txt.txt
Files
(2.2 MB)
| Name | Size | Download all |
|---|---|---|
|
md5:4ea35ae6aa88176bd79479aef29e5c98
|
2.2 MB | Download |
|
md5:e5fa844cc71f343ef8e5101b3a158d40
|
255 Bytes | Preview Download |