Skip to content

GitLab

"...reference/src/SimTKReference/ReferenceCCMAAlgorithm.cpp" did not exist on "6fd7f3bbd14024553043323c0cce68769597d26a"
Commit 7a55f02c authored by Lee-Ping Wang's avatar Lee-Ping Wang
Browse files

Reverted testInstallation.py

parent abb5e39b
Hide whitespace changes
Inline Side-by-side
Showing with 1 addition and 1 deletion
examples/testInstallation.py
View file @ 7a55f02c
...@@ -13,7 +13,7 @@ except ImportError as err: ...@@ -13,7 +13,7 @@ except ImportError as err:
# Create a System for the tests. # Create a System for the tests.
pdb = PDBFile('input.pdb') pdb = PDBFile('input.pdb')
forcefield = ForceField('amoeba2009.xml') forcefield = ForceField('amber99sb.xml', 'tip3p.xml')
system = forcefield.createSystem(pdb.topology, nonbondedMethod=PME, nonbondedCutoff=1*nanometer, constraints=HBonds) system = forcefield.createSystem(pdb.topology, nonbondedMethod=PME, nonbondedCutoff=1*nanometer, constraints=HBonds)
# List all installed platforms and compute forces with each one. # List all installed platforms and compute forces with each one.
......
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