diff --git a/src/cltools/Driver.cpp b/src/cltools/Driver.cpp index 6ff69f1107f30dabca0f59ed7b94c3f2fd5df01a..3317468ef9a71013cd5854e4e17526659c86cc19 100644 --- a/src/cltools/Driver.cpp +++ b/src/cltools/Driver.cpp @@ -738,7 +738,7 @@ int Driver<real>::main(FILE* in,FILE*out,Communicator& pc) { matrix box; rvec* pos=new rvec[natoms]; float prec,lambda; - int ret; + int ret=exdrOK; if(trajectory_fmt=="xdr-xtc") ret=read_xtc(xd,natoms,&localstep,&time,box,pos,&prec); if(trajectory_fmt=="xdr-trr") ret=read_trr(xd,natoms,&localstep,&time,&lambda,box,pos,NULL,NULL); if(stride==0) step=localstep; diff --git a/src/gridtools/FindContourSurface.cpp b/src/gridtools/FindContourSurface.cpp index 8ffcaa716819abdad6722b15ad1eea0ef8f2c74b..4cbf9ded2e52a80ff49dd2468af27523090c1690 100644 --- a/src/gridtools/FindContourSurface.cpp +++ b/src/gridtools/FindContourSurface.cpp @@ -210,7 +210,7 @@ void FindContourSurface::finishAveraging() { } void FindContourSurface::compute( const unsigned& current, MultiValue& myvals ) const { - std::vector<unsigned> neighbours; unsigned num_neighbours; unsigned nfound=0; double minv=0, minp; + std::vector<unsigned> neighbours; unsigned num_neighbours; unsigned nfound=0; double minv=0, minp=0; std::vector<unsigned> bins_n( ingrid->getNbin() ); unsigned shiftn=current; std::vector<unsigned> ind( ingrid->getDimension() ); std::vector<double> point( ingrid->getDimension() ); #ifndef DNDEBUG diff --git a/src/multicolvar/MultiColvarBase.cpp b/src/multicolvar/MultiColvarBase.cpp index 987eb1532a5ef96b668a75c0c8dfb635eb1bdcad..ee5d4ffa296625c812ae028a7109084ae5f21987 100644 --- a/src/multicolvar/MultiColvarBase.cpp +++ b/src/multicolvar/MultiColvarBase.cpp @@ -32,6 +32,7 @@ #include "CatomPack.h" #include <vector> #include <string> +#include <limits> using namespace std; @@ -696,7 +697,7 @@ void MultiColvarBase::calculate() { if( !usespecies && ablocks.size()>1 ) { // This loop finds the first active atom, which is always checked because // of a peculiarity in linkcells - unsigned first_active; + unsigned first_active=std::numeric_limits<unsigned>::max(); for(unsigned i=0; i<ablocks[0].size(); ++i) { if( !isCurrentlyActive( ablocks[1][i] ) ) continue; else {