MBX v1.1.0 [2024-04-22]Download v1.1.0

Release Notes

  • Major update: MBX version 1.1 has been released containing significant performance improvements, specifically in the real-space electrostatics part of the PEF.

Changelog

  • Significant performance improvements to the real-space electrostatics part of the PEF.
  • Added bin/mb_decomp executable, generated by make install when compiling stand-alone MBX. This executable can be used to perform many-body decomposition of input structures.