Changed default value for Ewald error tolerance

f0cab877 · Peter Eastman · aa96846e · f0cab877
Commit f0cab877 authored Oct 24, 2009 by Peter Eastman
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openmmapi/src/NonbondedForce.cpp openmmapi/src/NonbondedForce.cpp +1 -1

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--- a/openmmapi/src/NonbondedForce.cpp
+++ b/openmmapi/src/NonbondedForce.cpp
@@ -46,7 +46,7 @@ using std::string;
 using std::stringstream;
 using std::vector;

-NonbondedForce::NonbondedForce() : nonbondedMethod(NoCutoff), cutoffDistance(1.0), rfDielectric(78.3), ewaldErrorTol(1e-4) {
+NonbondedForce::NonbondedForce() : nonbondedMethod(NoCutoff), cutoffDistance(1.0), rfDielectric(78.3), ewaldErrorTol(5e-4) {
 }

 NonbondedForce::NonbondedMethod NonbondedForce::getNonbondedMethod() const {