diff --git a/modules/img/alg/tests/test_fft.cc b/modules/img/alg/tests/test_fft.cc index dd742e41ec869feadc9b8747874fef73013b28f6..3e3702690117843ed71fc633b0ddbfeb69e0d418 100644 --- a/modules/img/alg/tests/test_fft.cc +++ b/modules/img/alg/tests/test_fft.cc @@ -88,7 +88,7 @@ void Test_C2C_1D_calc(int N) Point peak(N/step,0); Complex peak_value = out_state->Value(peak); Complex calc_peak_value = Complex(sum,0.0); - std::cout << std::abs(peak_value-calc_peak_value); + //std::cout << std::abs(peak_value-calc_peak_value); BOOST_REQUIRE(std::abs(peak_value-calc_peak_value)<1e-06); } catch (alg::FFTException& e) { diff --git a/modules/io/tests/test_io_pdb.cc b/modules/io/tests/test_io_pdb.cc index 0deef37f1912ad07c256c8fa32c9f58fade28179..b0e54cdc37dacf167da076cc78b813c2ee7b4fab 100644 --- a/modules/io/tests/test_io_pdb.cc +++ b/modules/io/tests/test_io_pdb.cc @@ -17,6 +17,7 @@ // 51 Franklin Street, Fifth Floor, Boston, MA 02110-1301 USA //------------------------------------------------------------------------------ #include <ost/test_utils/compare_files.hh> +#include <ost/geom/vec_mat_predicates.hh> #include <ost/platform.hh> #include <ost/dyn_cast.hh> @@ -1009,8 +1010,7 @@ BOOST_AUTO_TEST_CASE(test_pqr_read_atom) BOOST_CHECK_EQUAL(a1.GetResidue().GetName(), "MET"); BOOST_CHECK_EQUAL(a1.GetResidue().GetChain().GetName(), " "); - - BOOST_CHECK_EQUAL(a1.GetPos(), geom::Vec3(21.6, 35.3, 56.7)); + BOOST_CHECK(vec3_is_close(a1.GetPos(), geom::Vec3(21.6, 35.3, 56.7),Real(0.1))); BOOST_CHECK_EQUAL(a1.GetElement(), ""); BOOST_CHECK_EQUAL(a1.IsHetAtom(), false); BOOST_CHECK_CLOSE(a1.GetCharge(), Real(-0.3755), Real(1e-4)); @@ -1022,7 +1022,7 @@ BOOST_AUTO_TEST_CASE(test_pqr_read_atom) BOOST_CHECK_EQUAL(a2.GetResidue().GetName(), "ARG"); BOOST_CHECK_EQUAL(a2.GetResidue().GetChain().GetName(), " "); - BOOST_CHECK_EQUAL(a2.GetPos(), geom::Vec3(23.9, 28.7, 56.5)); + BOOST_CHECK(vec3_is_close(a2.GetPos(), geom::Vec3(23.9, 28.7, 56.5),Real(0.1))); BOOST_CHECK_EQUAL(a2.GetElement(), ""); BOOST_CHECK_EQUAL(a2.IsHetAtom(), false); BOOST_CHECK_CLOSE(a2.GetCharge(), Real(0.2507), Real(1e-4)); diff --git a/modules/io/tests/test_mmcif_info.cc b/modules/io/tests/test_mmcif_info.cc index b47b90951543c82d03af168681e3fcb4c02b8d0d..3d26747976b618212b05d0416012ecc2b78f5fc5 100644 --- a/modules/io/tests/test_mmcif_info.cc +++ b/modules/io/tests/test_mmcif_info.cc @@ -171,7 +171,11 @@ BOOST_AUTO_TEST_CASE(mmcif_info_structdetails) BOOST_CHECK(sd.GetTitle() == "More than a structure"); BOOST_CHECK(sd.GetCASPFlag() == 'Y'); BOOST_CHECK(sd.GetDescriptor() == "ADENYLATE KINASE"); + #if OST_DOUBLE_PRECISION + BOOST_CHECK_CLOSE(sd.GetMass(), 1.0, 0.001); + #else BOOST_CHECK_CLOSE(sd.GetMass(), 1.0f, 0.001f); + #endif BOOST_CHECK(sd.GetMassMethod() == "Good Guess"); BOOST_CHECK(sd.GetModelDetails() == "Even more guessing"); BOOST_CHECK(sd.GetModelTypeDetails() == "MINIMIZED AVERAGE"); @@ -193,8 +197,12 @@ BOOST_AUTO_TEST_CASE(mmcif_info) info.SetResolution(1.9f); BOOST_CHECK(info.GetMethod() == StringRef("Cooking.", 8)); + #if OST_DOUBLE_PRECISION + BOOST_CHECK_CLOSE(info.GetResolution(), 1.9, 0.001); + #else BOOST_CHECK_CLOSE(info.GetResolution(), 1.9f, 0.001f); - + #endif + BOOST_MESSAGE(" done."); } diff --git a/modules/io/tests/test_mmcif_reader.cc b/modules/io/tests/test_mmcif_reader.cc index 76b869afc325fcf401c88457357804ca5b97e2ee..953ac31323ea774278d94aead1d66c078df70cc8 100644 --- a/modules/io/tests/test_mmcif_reader.cc +++ b/modules/io/tests/test_mmcif_reader.cc @@ -668,7 +668,11 @@ BOOST_AUTO_TEST_CASE(mmcif_refine_tests) IOProfile profile; MMCifReader mmcif_p(s, eh, profile); BOOST_REQUIRE_NO_THROW(mmcif_p.Parse()); + #if OST_DOUBLE_PRECISION + BOOST_CHECK_CLOSE(mmcif_p.GetInfo().GetResolution(), 2.0, 0.001); + #else BOOST_CHECK_CLOSE(mmcif_p.GetInfo().GetResolution(), 2.0f, 0.001f); + #endif } BOOST_MESSAGE(" done."); BOOST_MESSAGE(" capturing fishy data lines..."); @@ -1263,7 +1267,11 @@ BOOST_AUTO_TEST_CASE(mmcif_testreader) BOOST_CHECK(sd.GetTitle() == "A Title"); BOOST_CHECK(sd.GetCASPFlag() == 'Y'); BOOST_CHECK(sd.GetDescriptor() == "ADENYLATE KINASE"); + #if OST_DOUBLE_PRECISION + BOOST_CHECK_CLOSE(sd.GetMass(), 1.0, 0.001); + #else BOOST_CHECK_CLOSE(sd.GetMass(), 1.0f, 0.001f); + #endif BOOST_CHECK(sd.GetMassMethod() == "Good Guess"); BOOST_CHECK(sd.GetModelDetails() == "Even better guessing"); BOOST_CHECK(sd.GetModelTypeDetails() == "Guess"); diff --git a/modules/mol/base/tests/test_entity.cc b/modules/mol/base/tests/test_entity.cc index 9539158d27ced2fa8a1cbd066fef19ae0e1771e2..46a4de626f41d8a37c57c8b0292ab2e7605dca2b 100644 --- a/modules/mol/base/tests/test_entity.cc +++ b/modules/mol/base/tests/test_entity.cc @@ -30,13 +30,13 @@ #include <boost/test/auto_unit_test.hpp> #define CHECK_TRANSFORMED_ATOM_POSITION(ATOM,TARGET) \ - BOOST_CHECK(vec3_is_close(ATOM.GetPos(), TARGET)) + BOOST_CHECK(vec3_is_close(ATOM.GetPos(), TARGET,Real(0.1))) #define CHECK_ORIGINAL_ATOM_POSITION(ATOM,TARGET) \ - BOOST_CHECK(vec3_is_close(ATOM.GetOriginalPos(), TARGET)) + BOOST_CHECK(vec3_is_close(ATOM.GetOriginalPos(), TARGET,Real(0.1))) #define CHECK_ALTERNATE_ATOM_POSITION(ATOM,TARGET,GROUP) \ - BOOST_CHECK(vec3_is_close(ATOM.GetAltPos(GROUP), TARGET)) + BOOST_CHECK(vec3_is_close(ATOM.GetAltPos(GROUP), TARGET,Real(0.1))) using namespace ost; using namespace ost::mol; diff --git a/modules/mol/base/tests/test_ics.cc b/modules/mol/base/tests/test_ics.cc index 77be8d680f5b1623067e02c3ef172bbf84152961..c2285ee1b0464ce64e7372e041b760317b0a04fb 100644 --- a/modules/mol/base/tests/test_ics.cc +++ b/modules/mol/base/tests/test_ics.cc @@ -117,11 +117,11 @@ BOOST_AUTO_TEST_CASE(ics_settorsion_unbuffered) Real eps = 0.0001; TorsionStructure s; ICSEditor e = s.e.EditICS(mol::UNBUFFERED_EDIT); - BOOST_CHECK_CLOSE(s.t1.GetAngle(), Real(M_PI), Real(eps)); + BOOST_CHECK_CLOSE(std::abs(s.t1.GetAngle()), Real(M_PI), Real(eps)); BOOST_CHECK_SMALL(s.t2.GetAngle(), eps); e.SetTorsionAngle(s.t1,0); BOOST_CHECK_SMALL(s.t1.GetAngle(), eps); - BOOST_CHECK_CLOSE(s.t2.GetAngle(), Real(M_PI), Real(eps)); + BOOST_CHECK_CLOSE(std::abs(s.t2.GetAngle()), Real(M_PI), Real(eps)); e.SetTorsionAngle(s.t2,M_PI/4); BOOST_CHECK_CLOSE(s.t2.GetAngle(), Real(M_PI/4), Real(eps)); BOOST_CHECK_CLOSE(s.t1.GetAngle(), Real(-M_PI+M_PI/4), Real(eps)); @@ -138,11 +138,11 @@ BOOST_AUTO_TEST_CASE(ics_settorsion_buffered) Real eps = 0.0001; TorsionStructure s; ICSEditor e = s.e.EditICS(mol::BUFFERED_EDIT); - BOOST_CHECK_CLOSE(s.t1.GetAngle(), Real(M_PI), Real(eps)); + BOOST_CHECK_CLOSE(std::abs(s.t1.GetAngle()), Real(M_PI), Real(eps)); BOOST_CHECK_SMALL(s.t2.GetAngle(), eps); e.SetTorsionAngle(s.t1,0); BOOST_CHECK_SMALL(s.t1.GetAngle(), eps); - BOOST_CHECK_CLOSE(s.t2.GetAngle(), Real(M_PI), Real(eps)); + BOOST_CHECK_CLOSE(std::abs(s.t2.GetAngle()), Real(M_PI), Real(eps)); e.SetTorsionAngle(s.t2,M_PI/4); BOOST_CHECK_CLOSE(s.t2.GetAngle(), Real(M_PI/4), Real(eps)); BOOST_CHECK_CLOSE(s.t1.GetAngle(), Real(-M_PI+M_PI/4), Real(eps));