DDtrek:PyMOL3D

Evgenii M Osipov1, Sergei V Strelkov1

  • 1Laboratory for Biocrystallography, Department of Pharmaceutical and Pharmacological Sciences, Katholieke Universiteit Leuven, Herestraat 49, Box 822, 3000 Leuven, Belgium.

ACS omega
|June 9, 2025
PubMed
概括

DDtrek是一个新的PyMOL插件,用于对准和评估生物宏分子结构. 它通过可视化连接体和实验密度图来帮助基于结构的药物设计,用于模型可靠性评估.