在MS 5.5的Forcite模块做几何优化时,提示:
6 bond stretch(s) have been deleted from the energy expression as they have no forcefield parameters.
9 inversion(s) have been deleted from the energy expression as they have no forcefield parameters.
并且构型也很诡异,这6个键上连的原子都跑出去了,如图1所示。