ZINC26: Difference between revisions
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== Introduction == | == Introduction == | ||
ZINC26 is a search tool for purchasable chemical space. It uses Smallworld and Arthor technology from NextMove Software to allow searching billions of molecules in seconds. There is a batch interface and an interactive one. | ZINC26 is a search tool for purchasable chemical space. It uses Smallworld and Arthor technology from NextMove Software to allow searching billions of molecules in seconds. There is a batch interface and an interactive one. | ||
* help page: [[ZINC26:Help]] | |||
The new database is organized around a set of [[ZINC26:Principles | principles]]. | The new database is organized around a set of [[ZINC26:Principles | principles]]. | ||
Latest revision as of 17:53, 8 July 2026
Introduction
ZINC26 is a search tool for purchasable chemical space. It uses Smallworld and Arthor technology from NextMove Software to allow searching billions of molecules in seconds. There is a batch interface and an interactive one.
- help page: ZINC26:Help
The new database is organized around a set of principles.
API
- zinc26dev.docking.org/docs describes how to use. Here is a short tutorial to get you started.
Coming soon
- 3d database builder
- additional data
Tutorial in how to use datawarrior
- the columns in datawarrior are as follows.
- we are still working on adding a net_charge column.
- we suggest you proceed as follows.