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RISM-MOL

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Tool for fast and accurate Hydration Free Energies calculations

RISM-MOL-logo.png
  • Fast multi-grid RISM solver
  • Six different Hydration Free Energy expressions
  • RDF calculations
  • Flexible settings

System requirements: Matlab 6 or later / Octave

How to start with RISM-MOL
Download User Manual

Download RISM-MOL