Changes in util/src/CalculateMass.sh.in [5db625:ae21a39]
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util/src/CalculateMass.sh.in (modified) (1 diff)
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util/src/CalculateMass.sh.in
r5db625 rae21a39 3 3 # calculates mass of a molecule in a XYZ file 4 4 5 ELEMENTSDB=" /home/heber/workspace/ESPACK/bin/elements.db"5 ELEMENTSDB="@bindir@/elements.db" 6 6 7 7 if [ -z "$1" ]; then
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