Unverified Commit a5e42f57 authored by Peter Eastman's avatar Peter Eastman Committed by GitHub
Browse files

Improved temperature reporting for Drude particles (#3486)

* DrudeLangevinIntegrator has getSystemTemperature()

* DrudeNoseHooverIntegrator has getSystemTemperature()

* StateDataReporter reports system temperature for Drude systems

* Fixed incorrect return type
parent b33a7a5a
...@@ -225,6 +225,7 @@ UNITS = { ...@@ -225,6 +225,7 @@ UNITS = {
("*", "getNonbondedMethod") : (None, ()), ("*", "getNonbondedMethod") : (None, ()),
("*", "getGlobalParameterDefaultValue") : (None, ()), ("*", "getGlobalParameterDefaultValue") : (None, ()),
("*", "getPermutationMode") : (None, ()), ("*", "getPermutationMode") : (None, ()),
("*", "computeSystemTemperature") : ("unit.kelvin", ()),
("LocalCoordinatesSite", "getOriginWeights") : (None, ()), ("LocalCoordinatesSite", "getOriginWeights") : (None, ()),
("LocalCoordinatesSite", "getXWeights") : (None, ()), ("LocalCoordinatesSite", "getXWeights") : (None, ()),
("LocalCoordinatesSite", "getYWeights") : (None, ()), ("LocalCoordinatesSite", "getYWeights") : (None, ()),
......
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