X-Git-Url: http://biod.pnpi.spb.ru/gitweb/?a=blobdiff_plain;f=src%2Fgromacs%2Fmodularsimulator%2Fmodularsimulator.cpp;h=03e64cc6e36c6fdb4c95fd04625eab68fed98a4a;hb=f3f4224ea504eef7ba021f0f37fa9d2fc532505f;hp=fac5ea0d86bfd2c0db059fe66598559d18d15617;hpb=f7883d21c6073ce30fcf7a91c5f8c0cc0a598c74;p=alexxy%2Fgromacs.git diff --git a/src/gromacs/modularsimulator/modularsimulator.cpp b/src/gromacs/modularsimulator/modularsimulator.cpp index fac5ea0d86..03e64cc6e3 100644 --- a/src/gromacs/modularsimulator/modularsimulator.cpp +++ b/src/gromacs/modularsimulator/modularsimulator.cpp @@ -401,7 +401,7 @@ bool ModularSimulator::isInputCompatible(bool exitOn && conditionalAssert(!doRerun, "Rerun is not supported by the modular simulator."); isInputCompatible = isInputCompatible - && conditionalAssert(inputrec->cos_accel == 0.0, + && conditionalAssert(!inputrec->useConstantAcceleration && inputrec->cos_accel == 0.0, "Acceleration is not supported by the modular simulator."); isInputCompatible = isInputCompatible