zinc-database

Name: zinc-database
Author: lamm-mit

Access ZINC (230M+ purchasable compounds). Search by ZINC ID/SMILES, similarity searches, 3D-ready structures for docking, analog discovery, for virtual screening and drug discovery.

檢視原始碼 computational-chemistry

maintainer

lamm-mit

更新於 3/14/2026

星標

156

分支

quick start

Installation and usage

Access ZINC (230M+ purchasable compounds). Search by ZINC ID/SMILES, similarity searches, 3D-ready structures for docking, analog discovery, for virtual screening and drug discovery.

安裝

$ install --globalskills.sh

使用

安裝後，您可以透過在終端機執行以下指令來使用此技能：

skills use zinc-database