Commit 53f03e6a authored by Peter Eastman's avatar Peter Eastman
Browse files

Fixed a few problems related to GBSA

parent 02432980
......@@ -117,7 +117,7 @@ ELSE(CUDA_BUILD_TYPE MATCHES "Emulation")
ENDIF(CUDA_BUILD_TYPE MATCHES "Emulation")
SET(CUDA_BUILD_CUBIN TRUE CACHE BOOL "Generate and parse .cubin files in Device mode.")
SET(CUDA_NVCC_FLAGS "" CACHE STRING "Semi-colon delimit multiple arguments.")
SET(CUDA_NVCC_FLAGS "-maxrregcount=32;-use_fast_math;-O0" CACHE STRING "Semi-colon delimit multiple arguments.")
# Search for the cuda distribution.
IF(NOT CUDA_INSTALL_PREFIX)
......
......@@ -33,7 +33,7 @@
* -------------------------------------------------------------------------- */
#include "StreamImpl.h"
#include "kernels/cudatypes.h"
#include "kernels/gputypes.h"
namespace OpenMM {
......
......@@ -756,7 +756,7 @@ int ImplicitSolventParameters::isNotReady( void ) const {
if( average < 0.1 || average > 1.0 || minValue < 0.05 ){
errors++;
message << "\n atomic radii appear not to be set correctly -- radii should be in Angstroms";
message << "\n atomic radii appear not to be set correctly -- radii should be in nanometers";
message << "\n average radius=" << average << " min radius=" << minValue << " at atom index=" << minIndex;
}
......
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