Commit 6dc080e9 authored by Jason Swails's avatar Jason Swails
Browse files

Ack. Copy-and-paste errors.

parent d1414350
......@@ -774,7 +774,7 @@ class CharmmPsfFile(object):
elem = element.Element.getByAtomicNumber(atomic_num)
else:
# Figure it out from the mass
masselem = element.Element.getByMass(mass)
masselem = element.Element.getByMass(atom.mass)
if masselem is None:
atomic_number = 0 # Extra point or something
else:
......
Markdown is supported
0% or .
You are about to add 0 people to the discussion. Proceed with caution.
Finish editing this message first!
Please register or to comment