Centre for Genomic Regulation (CRG), The Barcelona Institute for Science and Technology, Barcelona, Spain.
Universitat Pompeu Fabra (UPF), Barcelona, Spain.
Bioinformatics. 2019 Oct 15;35(20):4168-4169. doi: 10.1093/bioinformatics/btz184.
A new version of FoldX, whose main new features allows running classic FoldX commands on structures containing RNA molecules and includes a module that allows parametrization of ligands or small molecules (ParamX) that were not previously recognized in old versions, has been released. An extended FoldX graphical user interface has also being developed (available as a python plugin for the YASARA molecular viewer) allowing user-friendly parametrization of new custom user molecules encoded using JSON format.
新版本的 FoldX 已经发布，其主要新功能允许在包含 RNA 分子的结构上运行经典的 FoldX 命令，并包含一个模块，允许对以前在旧版本中未识别的配体或小分子（ParamX）进行参数化。还开发了一个扩展的 FoldX 图形用户界面（可作为 YASARA 分子查看器的 Python 插件使用），允许使用 JSON 格式对新的自定义用户分子进行用户友好的参数化。
