/dports/science/openbabel/openbabel-3.1.1/test/pdb_ligands_sdf/ |
H A D | 2z9l_daz.sdf | 81 InChI=1S/2H2N.Zn/h2*1H2;/q2*-1;+2
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/dports/biology/molden/molden5.8/plush/ |
H A D | 2J4 | 27 lab="H2N" NH="0"
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H A D | Z3Q | 31 lab="H2N" NH="0"
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/dports/science/py-MDAnalysisTests/MDAnalysisTests-0.19.2/MDAnalysisTests/data/Amber/ |
H A D | chitosan.prmtop | 14 N2 H2N C2N O2N CME H3M H2M H1M O4 C1 H1 O5 C5 H5 C6 H62 H61 O6 H6O C4 15 H4 C3 H3 O3 H3O C2 H2 N2 H2N C2N O2N CME H3M H2M H1M O4 C1 H1 O5 C5 19 H1 O5 C5 H5 C6 H62 H61 O6 H6O C4 H4 C3 H3 O3 H3O C2 H2 N2 H2N C2N 21 O3 H3O C2 H2 N2 H2N C2N O2N CME H3M H2M H1M O4 C1 H1 O5 C5 H5 C6 H62 22 H61 O6 H6O C4 H4 C3 H3 O3 H3O C2 H2 N2 H2N C2N O2N CME H3M H2M H1M O4 23 C1 H1 O5 C5 H5 C6 H62 H61 O6 H6O C4 H4 C3 H3 O3 H3O C2 H2 N2 H2N 25 H4O C3 H3 O3 H3O C2 H2 N2 H2N C2N O2N CME H3M H2M H1M
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/dports/devel/llvm-cheri/llvm-project-37c49ff00e3eadce5d8703fdc4497f28458c64a8/llvm/unittests/Analysis/ |
H A D | CGSCCPassManagerTest.cpp | 1197 auto &H2N = *llvm::find_if( in TEST_F() local 1199 auto &H2F = H2N.getFunction(); in TEST_F() 1210 updateCGAndAnalysisManagerForFunctionPass(CG, C, H2N, AM, UR, FAM); in TEST_F() 1246 auto &H2N = *C.begin(); in TEST_F() local 1247 auto &H2F = H2N.getFunction(); in TEST_F() 1256 updateCGAndAnalysisManagerForFunctionPass(CG, C, H2N, AM, UR, FAM); in TEST_F() 1365 auto &H2N = *llvm::find_if( in TEST_F() local 1368 updateCGAndAnalysisManagerForCGSCCPass(CG, C, H2N, AM, UR, FAM)); in TEST_F() 1402 auto &H2N = *llvm::find_if( in TEST_F() local 1405 updateCGAndAnalysisManagerForFunctionPass(CG, C, H2N, AM, UR, FAM), in TEST_F()
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/dports/devel/llvm11/llvm-11.0.1.src/unittests/Analysis/ |
H A D | CGSCCPassManagerTest.cpp | 1197 auto &H2N = *llvm::find_if( in TEST_F() local 1199 auto &H2F = H2N.getFunction(); in TEST_F() 1210 updateCGAndAnalysisManagerForFunctionPass(CG, C, H2N, AM, UR, FAM); in TEST_F() 1246 auto &H2N = *C.begin(); in TEST_F() local 1247 auto &H2F = H2N.getFunction(); in TEST_F() 1256 updateCGAndAnalysisManagerForFunctionPass(CG, C, H2N, AM, UR, FAM); in TEST_F() 1365 auto &H2N = *llvm::find_if( in TEST_F() local 1368 updateCGAndAnalysisManagerForCGSCCPass(CG, C, H2N, AM, UR, FAM)); in TEST_F() 1402 auto &H2N = *llvm::find_if( in TEST_F() local 1405 updateCGAndAnalysisManagerForFunctionPass(CG, C, H2N, AM, UR, FAM), in TEST_F()
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/dports/www/chromium-legacy/chromium-88.0.4324.182/third_party/llvm/llvm/unittests/Analysis/ |
H A D | CGSCCPassManagerTest.cpp | 1197 auto &H2N = *llvm::find_if( in TEST_F() local 1199 auto &H2F = H2N.getFunction(); in TEST_F() 1210 updateCGAndAnalysisManagerForFunctionPass(CG, C, H2N, AM, UR, FAM); in TEST_F() 1246 auto &H2N = *C.begin(); in TEST_F() local 1247 auto &H2F = H2N.getFunction(); in TEST_F() 1256 updateCGAndAnalysisManagerForFunctionPass(CG, C, H2N, AM, UR, FAM); in TEST_F() 1365 auto &H2N = *llvm::find_if( in TEST_F() local 1368 updateCGAndAnalysisManagerForCGSCCPass(CG, C, H2N, AM, UR, FAM)); in TEST_F() 1402 auto &H2N = *llvm::find_if( in TEST_F() local 1405 updateCGAndAnalysisManagerForFunctionPass(CG, C, H2N, AM, UR, FAM), in TEST_F()
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/dports/devel/llvm-devel/llvm-project-f05c95f10fc1d8171071735af8ad3a9e87633120/llvm/unittests/Analysis/ |
H A D | CGSCCPassManagerTest.cpp | 1197 auto &H2N = *llvm::find_if( in TEST_F() local 1199 auto &H2F = H2N.getFunction(); in TEST_F() 1210 updateCGAndAnalysisManagerForFunctionPass(CG, C, H2N, AM, UR, FAM); in TEST_F() 1246 auto &H2N = *C.begin(); in TEST_F() local 1247 auto &H2F = H2N.getFunction(); in TEST_F() 1256 updateCGAndAnalysisManagerForFunctionPass(CG, C, H2N, AM, UR, FAM); in TEST_F() 1365 auto &H2N = *llvm::find_if( in TEST_F() local 1368 updateCGAndAnalysisManagerForCGSCCPass(CG, C, H2N, AM, UR, FAM)); in TEST_F() 1402 auto &H2N = *llvm::find_if( in TEST_F() local 1405 updateCGAndAnalysisManagerForFunctionPass(CG, C, H2N, AM, UR, FAM), in TEST_F()
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/dports/lang/rust/rustc-1.58.1-src/src/llvm-project/llvm/unittests/Analysis/ |
H A D | CGSCCPassManagerTest.cpp | 1197 auto &H2N = *llvm::find_if( in TEST_F() local 1199 auto &H2F = H2N.getFunction(); in TEST_F() 1210 updateCGAndAnalysisManagerForFunctionPass(CG, C, H2N, AM, UR, FAM); in TEST_F() 1246 auto &H2N = *C.begin(); in TEST_F() local 1247 auto &H2F = H2N.getFunction(); in TEST_F() 1256 updateCGAndAnalysisManagerForFunctionPass(CG, C, H2N, AM, UR, FAM); in TEST_F() 1365 auto &H2N = *llvm::find_if( in TEST_F() local 1368 updateCGAndAnalysisManagerForCGSCCPass(CG, C, H2N, AM, UR, FAM)); in TEST_F() 1402 auto &H2N = *llvm::find_if( in TEST_F() local 1405 updateCGAndAnalysisManagerForFunctionPass(CG, C, H2N, AM, UR, FAM), in TEST_F()
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/dports/devel/wasi-compiler-rt12/llvm-project-12.0.1.src/llvm/unittests/Analysis/ |
H A D | CGSCCPassManagerTest.cpp | 1198 auto &H2N = *llvm::find_if( in TEST_F() local 1200 auto &H2F = H2N.getFunction(); in TEST_F() 1211 updateCGAndAnalysisManagerForFunctionPass(CG, C, H2N, AM, UR, FAM); in TEST_F() 1247 auto &H2N = *C.begin(); in TEST_F() local 1248 auto &H2F = H2N.getFunction(); in TEST_F() 1257 updateCGAndAnalysisManagerForFunctionPass(CG, C, H2N, AM, UR, FAM); in TEST_F() 1366 auto &H2N = *llvm::find_if( in TEST_F() local 1369 updateCGAndAnalysisManagerForCGSCCPass(CG, C, H2N, AM, UR, FAM)); in TEST_F() 1403 auto &H2N = *llvm::find_if( in TEST_F() local 1406 updateCGAndAnalysisManagerForFunctionPass(CG, C, H2N, AM, UR, FAM), in TEST_F()
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/dports/devel/wasi-compiler-rt13/llvm-project-13.0.1.src/llvm/unittests/Analysis/ |
H A D | CGSCCPassManagerTest.cpp | 1197 auto &H2N = *llvm::find_if( in TEST_F() local 1199 auto &H2F = H2N.getFunction(); in TEST_F() 1210 updateCGAndAnalysisManagerForFunctionPass(CG, C, H2N, AM, UR, FAM); in TEST_F() 1246 auto &H2N = *C.begin(); in TEST_F() local 1247 auto &H2F = H2N.getFunction(); in TEST_F() 1256 updateCGAndAnalysisManagerForFunctionPass(CG, C, H2N, AM, UR, FAM); in TEST_F() 1365 auto &H2N = *llvm::find_if( in TEST_F() local 1368 updateCGAndAnalysisManagerForCGSCCPass(CG, C, H2N, AM, UR, FAM)); in TEST_F() 1402 auto &H2N = *llvm::find_if( in TEST_F() local 1405 updateCGAndAnalysisManagerForFunctionPass(CG, C, H2N, AM, UR, FAM), in TEST_F()
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/dports/devel/wasi-libcxx/llvm-project-13.0.1.src/llvm/unittests/Analysis/ |
H A D | CGSCCPassManagerTest.cpp | 1197 auto &H2N = *llvm::find_if( in TEST_F() local 1199 auto &H2F = H2N.getFunction(); in TEST_F() 1210 updateCGAndAnalysisManagerForFunctionPass(CG, C, H2N, AM, UR, FAM); in TEST_F() 1246 auto &H2N = *C.begin(); in TEST_F() local 1247 auto &H2F = H2N.getFunction(); in TEST_F() 1256 updateCGAndAnalysisManagerForFunctionPass(CG, C, H2N, AM, UR, FAM); in TEST_F() 1365 auto &H2N = *llvm::find_if( in TEST_F() local 1368 updateCGAndAnalysisManagerForCGSCCPass(CG, C, H2N, AM, UR, FAM)); in TEST_F() 1402 auto &H2N = *llvm::find_if( in TEST_F() local 1405 updateCGAndAnalysisManagerForFunctionPass(CG, C, H2N, AM, UR, FAM), in TEST_F()
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/dports/devel/llvm12/llvm-project-12.0.1.src/llvm/unittests/Analysis/ |
H A D | CGSCCPassManagerTest.cpp | 1198 auto &H2N = *llvm::find_if( in TEST_F() local 1200 auto &H2F = H2N.getFunction(); in TEST_F() 1211 updateCGAndAnalysisManagerForFunctionPass(CG, C, H2N, AM, UR, FAM); in TEST_F() 1247 auto &H2N = *C.begin(); in TEST_F() local 1248 auto &H2F = H2N.getFunction(); in TEST_F() 1257 updateCGAndAnalysisManagerForFunctionPass(CG, C, H2N, AM, UR, FAM); in TEST_F() 1366 auto &H2N = *llvm::find_if( in TEST_F() local 1369 updateCGAndAnalysisManagerForCGSCCPass(CG, C, H2N, AM, UR, FAM)); in TEST_F() 1403 auto &H2N = *llvm::find_if( in TEST_F() local 1406 updateCGAndAnalysisManagerForFunctionPass(CG, C, H2N, AM, UR, FAM), in TEST_F()
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/dports/graphics/llvm-mesa/llvm-13.0.1.src/unittests/Analysis/ |
H A D | CGSCCPassManagerTest.cpp | 1197 auto &H2N = *llvm::find_if( in TEST_F() local 1199 auto &H2F = H2N.getFunction(); in TEST_F() 1210 updateCGAndAnalysisManagerForFunctionPass(CG, C, H2N, AM, UR, FAM); in TEST_F() 1246 auto &H2N = *C.begin(); in TEST_F() local 1247 auto &H2F = H2N.getFunction(); in TEST_F() 1256 updateCGAndAnalysisManagerForFunctionPass(CG, C, H2N, AM, UR, FAM); in TEST_F() 1365 auto &H2N = *llvm::find_if( in TEST_F() local 1368 updateCGAndAnalysisManagerForCGSCCPass(CG, C, H2N, AM, UR, FAM)); in TEST_F() 1402 auto &H2N = *llvm::find_if( in TEST_F() local 1405 updateCGAndAnalysisManagerForFunctionPass(CG, C, H2N, AM, UR, FAM), in TEST_F()
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/dports/devel/llvm13/llvm-project-13.0.1.src/llvm/unittests/Analysis/ |
H A D | CGSCCPassManagerTest.cpp | 1197 auto &H2N = *llvm::find_if( in TEST_F() local 1199 auto &H2F = H2N.getFunction(); in TEST_F() 1210 updateCGAndAnalysisManagerForFunctionPass(CG, C, H2N, AM, UR, FAM); in TEST_F() 1246 auto &H2N = *C.begin(); in TEST_F() local 1247 auto &H2F = H2N.getFunction(); in TEST_F() 1256 updateCGAndAnalysisManagerForFunctionPass(CG, C, H2N, AM, UR, FAM); in TEST_F() 1365 auto &H2N = *llvm::find_if( in TEST_F() local 1368 updateCGAndAnalysisManagerForCGSCCPass(CG, C, H2N, AM, UR, FAM)); in TEST_F() 1402 auto &H2N = *llvm::find_if( in TEST_F() local 1405 updateCGAndAnalysisManagerForFunctionPass(CG, C, H2N, AM, UR, FAM), in TEST_F()
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/dports/devel/llvm90/llvm-9.0.1.src/unittests/Analysis/ |
H A D | CGSCCPassManagerTest.cpp | 1165 auto &H2N = *llvm::find_if( in TEST_F() local 1167 auto &H2F = H2N.getFunction(); in TEST_F() 1178 updateCGAndAnalysisManagerForFunctionPass(CG, C, H2N, AM, UR); in TEST_F() 1214 auto &H2N = *C.begin(); in TEST_F() local 1215 auto &H2F = H2N.getFunction(); in TEST_F() 1224 updateCGAndAnalysisManagerForFunctionPass(CG, C, H2N, AM, UR); in TEST_F()
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/dports/devel/llvm10/llvm-10.0.1.src/unittests/Analysis/ |
H A D | CGSCCPassManagerTest.cpp | 1165 auto &H2N = *llvm::find_if( in TEST_F() local 1167 auto &H2F = H2N.getFunction(); in TEST_F() 1178 updateCGAndAnalysisManagerForFunctionPass(CG, C, H2N, AM, UR); in TEST_F() 1214 auto &H2N = *C.begin(); in TEST_F() local 1215 auto &H2F = H2N.getFunction(); in TEST_F() 1224 updateCGAndAnalysisManagerForFunctionPass(CG, C, H2N, AM, UR); in TEST_F()
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/dports/devel/tinygo/tinygo-0.14.1/llvm-project/llvm/unittests/Analysis/ |
H A D | CGSCCPassManagerTest.cpp | 1165 auto &H2N = *llvm::find_if( in TEST_F() local 1167 auto &H2F = H2N.getFunction(); in TEST_F() 1178 updateCGAndAnalysisManagerForFunctionPass(CG, C, H2N, AM, UR); in TEST_F() 1214 auto &H2N = *C.begin(); in TEST_F() local 1215 auto &H2F = H2N.getFunction(); in TEST_F() 1224 updateCGAndAnalysisManagerForFunctionPass(CG, C, H2N, AM, UR); in TEST_F()
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/dports/devel/llvm80/llvm-8.0.1.src/unittests/Analysis/ |
H A D | CGSCCPassManagerTest.cpp | 1166 auto &H2N = *llvm::find_if( in TEST_F() local 1168 auto &H2F = H2N.getFunction(); in TEST_F() 1179 updateCGAndAnalysisManagerForFunctionPass(CG, C, H2N, AM, UR); in TEST_F() 1215 auto &H2N = *C.begin(); in TEST_F() local 1216 auto &H2F = H2N.getFunction(); in TEST_F() 1225 updateCGAndAnalysisManagerForFunctionPass(CG, C, H2N, AM, UR); in TEST_F()
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/dports/devel/llvm70/llvm-7.0.1.src/unittests/Analysis/ |
H A D | CGSCCPassManagerTest.cpp | 1159 auto &H2N = *llvm::find_if( 1161 auto &H2F = H2N.getFunction(); 1172 updateCGAndAnalysisManagerForFunctionPass(CG, C, H2N, AM, UR); 1208 auto &H2N = *C.begin(); 1209 auto &H2F = H2N.getFunction(); 1218 updateCGAndAnalysisManagerForFunctionPass(CG, C, H2N, AM, UR);
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/dports/science/drawxtl/DRAWxtl/examples/ |
H A D | porph_tst.str | 25 H2N 16500 58200 4100 H6N 8900 64800 7200 C6K -12610 -10080 9630
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/dports/textproc/groff/groff-1.22.4/contrib/chem/examples/122/ |
H A D | chBb_bonds.chem | 36 bond left length .15 from C ; H2N
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/dports/science/tinker/tinker/params/ |
H A D | amoeba04.prm | 149 atom 66 49 H "Methyl Amine H2N" 1 1.008 1 155 atom 72 49 H "Ethyl Amine H2N" 1 1.008 1 184 atom 101 55 H "Formamide H2N" 1 1.008 1 188 atom 105 55 H "Acetamide H2N" 1 1.008 1
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H A D | amoeba09.prm | 154 atom 66 50 H "Methyl Amine H2N" 1 1.008 1 158 atom 70 50 H "Ethyl Amine H2N" 1 1.008 1 191 atom 103 57 H "Formamide H2N" 1 1.008 1 195 atom 107 57 H "Acetamide H2N" 1 1.008 1
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/dports/science/gromacs/gromacs-2021.4/share/top/oplsaa.ff/ |
H A D | ffbonded.itp | 1626 …_2 NT H 3 -1.26775 3.02085 1.74473 -3.49782 0.00000 0.00000 ; H2N-terminus 1782 … CT_2 HC 3 0.83680 2.51040 0.00000 -3.34720 0.00000 0.00000 ; H2N-terminus 1829 … CT_2 NT 3 -4.09614 5.08775 2.96645 -3.95806 0.00000 0.00000 ; H2N-terminus 1902 …_2 C O 3 0.00000 0.00000 0.00000 0.00000 0.00000 0.00000 ; H2N-terminus 1903 …_2 CT S 3 3.40787 -2.80537 -0.35982 -0.24267 0.00000 0.00000 ; H2N-terminus 1904 …_2 CT SH 3 3.40787 -2.80537 -0.35982 -0.24267 0.00000 0.00000 ; H2N-terminus 2119 … CT_2 NT 3 3.33465 -1.55226 2.82001 -4.60240 0.00000 0.00000 ; H2N-terminus 2124 … CT_2 NT 3 3.33465 -1.55226 2.82001 -4.60240 0.00000 0.00000 ; H2N-terminus 2127 … CT_2 NT 3 3.33465 -1.55226 2.82001 -4.60240 0.00000 0.00000 ; H2N-terminus 2132 … CT_2 NT 3 3.33465 -1.55226 2.82001 -4.60240 0.00000 0.00000 ; H2N-terminus [all …]
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