Update README.md

alexagriffith · May 16, 2019 · d7c383d · d7c383d
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 Materials for MolSSI Workshop at SETCA 2019
 
 
-Geometry analysis script checks the distances between all atoms in an xyz file, and then checks if the distance falls within a give minimum and maximum bond length
+Geometry analysis script computes the distances between all atoms in an xyz file, and then checks if the distance falls within a give minimum and maximum bond length