Skip to content

GitLab

Commit 539678d0 authored by peastman's avatar peastman
Browse files

Fixed error on Python 2

parent 1d97e9ff
Show whitespace changes
Inline Side-by-side
Showing with 2 additions and 2 deletions
wrappers/python/simtk/openmm/app/modeller.py
View file @ 539678d0
...@@ -1192,8 +1192,8 @@ class Modeller(object): ...@@ -1192,8 +1192,8 @@ class Modeller(object):
patchPos = patchPdb.positions.value_in_unit(nanometer) patchPos = patchPdb.positions.value_in_unit(nanometer)
patchSize = patchPdb.topology.getUnitCellDimensions().value_in_unit(nanometer) patchSize = patchPdb.topology.getUnitCellDimensions().value_in_unit(nanometer)
patchCenterPos = (min(patchPos)+max(patchPos))/2 patchCenterPos = (min(patchPos)+max(patchPos))/2
nx = ceil((proteinSize[0]+2*minimumPadding)/patchSize[0]) nx = int(ceil((proteinSize[0]+2*minimumPadding)/patchSize[0]))
ny = ceil((proteinSize[1]+2*minimumPadding)/patchSize[1]) ny = int(ceil((proteinSize[1]+2*minimumPadding)/patchSize[1]))
# Identify the ion types. # Identify the ion types.
......
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