geauxdock.tar.gz
收藏DataCite Commons2020-09-04 更新2024-07-25 收录
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https://figshare.com/articles/dataset/geauxdock_tar_gz/3205249/1
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资源简介：
<strong>GeauxDock</strong> is an ultra-fast automated docking program, designed to predict how small ligands bind to pharmacologically relevant macromolecules. GeauxDock employs a novel hybrid force field, a mixed-resolution representation of protein-ligand complexes, and a Monte Carlo protocol for the efficient sampling of conformational space.<br><br><br><br>
提供机构：
figshare
创建时间：
2016-04-28
