"csrc/vscode:/vscode.git/clone" did not exist on "4d897ed14f32496cb7a6f0536d393c4f5ede7bfc"
Commit c73587b9 authored by Mark Friedrichs's avatar Mark Friedrichs
Browse files

Mods for GBVIForce interface methods to switching function for Born radii calculation

parent 881d5570
...@@ -406,6 +406,9 @@ UNITS = { ...@@ -406,6 +406,9 @@ UNITS = {
: (None, ('unit.elementary_charge', : (None, ('unit.elementary_charge',
'unit.nanometer', 'unit.dimensionless')), 'unit.nanometer', 'unit.dimensionless')),
("GBVIForce", "getNonbondedMethod") : (None, ()), ("GBVIForce", "getNonbondedMethod") : (None, ()),
("GBVIForce", "getBornRadiusScalingMethod") : (None, ()),
("GBVIForce", "getQuinticLowerLimitFactor") : (None, ()),
("GBVIForce", "getQuinticUpperBornRadiusLimit") : (None, ('unit.nanometer')),
("GBVIForce", "getBondParameters") ("GBVIForce", "getBondParameters")
: (None, (None, None, 'unit.nanometer')), : (None, (None, None, 'unit.nanometer')),
("GBVIForce", "getParticleParameters") ("GBVIForce", "getParticleParameters")
...@@ -424,7 +427,7 @@ UNITS = { ...@@ -424,7 +427,7 @@ UNITS = {
("GBVISoftcoreForce", "getNonbondedMethod") : (None, ()), ("GBVISoftcoreForce", "getNonbondedMethod") : (None, ()),
("GBVISoftcoreForce", "getBornRadiusScalingMethod") : (None, ()), ("GBVISoftcoreForce", "getBornRadiusScalingMethod") : (None, ()),
("GBVISoftcoreForce", "getQuinticLowerLimitFactor") : (None, ()), ("GBVISoftcoreForce", "getQuinticLowerLimitFactor") : (None, ()),
("GBVISoftcoreForce", "getQuinticUpperBornRadiusLimit") : (None, ()), ("GBVISoftcoreForce", "getQuinticUpperBornRadiusLimit") : (None, ('unit.nanometer')),
("GBVISoftcoreForce", "getTanhParameters") : (None, ()), ("GBVISoftcoreForce", "getTanhParameters") : (None, ()),
("HarmonicAngleForce", "getAngleParameters") ("HarmonicAngleForce", "getAngleParameters")
: (None, (None, None, None, 'unit.radian', : (None, (None, None, None, 'unit.radian',
......
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