/dports/science/tinker/tinker/params/ |
H A D | hippo19.prm | 173 atom 32 19 H "Methyl Amine H2N" 1 1.008 1 206 atom 65 45 H "Acetamide H2N" 1 1.008 1 298 atom 157 82 H "Guanidinium H2N" 1 1.008 1
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H A D | amoebabio09.prm | 376 atom 229 4 HN "Amide Cap H2N" 1 1.008 1 384 atom 237 37 H "N-Terminal H2N" 1 1.008 1 392 atom 245 42 HN "N-Terminal PRO H2N+" 1 1.008 1
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H A D | amoebapro04.prm | 315 atom 185 4 HN "Amide Cap H2N" 1 1.008 1 325 atom 195 38 HN "N-Terminal PRO H2N+" 1 1.008 1
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H A D | amoebapro13.prm | 377 atom 226 4 HN "Amide Cap H2N" 1 1.008 1 391 atom 240 42 HN "N-Terminal PRO H2N+" 1 1.008 1
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H A D | amoebabio18.prm | 367 atom 226 4 HN "Amide Cap H2N" 1 1.008 1 381 atom 240 42 HN "N-Terminal PRO H2N+" 1 1.008 1
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H A D | smoothua.prm | 57 atom 13 H "H2N Primary Amide" 1 1.008 1
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H A D | oplsua.prm | 127 atom 13 H "H2N Primary Amide" 1 1.008 1
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H A D | oplsaa.prm | 744 atom 692 101 NY "Neutral ARG N2 (H2N-C)" 7 14.007 3
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H A D | smoothaa.prm | 745 atom 689 91 NY "Neutral ARG N2 (H2N-C)" 7 14.007 3
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/dports/science/plumed/plumed2-2.7.2/regtest/basic/rt-hrex-2/ |
H A D | processed.top | 2455 …_2 NT H 3 -1.26775 3.02085 1.74473 -3.49782 0.00000 0.00000 ; H2N-terminus 2611 … CT_2 HC 3 0.83680 2.51040 0.00000 -3.34720 0.00000 0.00000 ; H2N-terminus 2658 … CT_2 NT 3 -4.09614 5.08775 2.96645 -3.95806 0.00000 0.00000 ; H2N-terminus 2731 …_2 C O 3 0.00000 0.00000 0.00000 0.00000 0.00000 0.00000 ; H2N-terminus 2732 …_2 CT S 3 3.40787 -2.80537 -0.35982 -0.24267 0.00000 0.00000 ; H2N-terminus 2733 …_2 CT SH 3 3.40787 -2.80537 -0.35982 -0.24267 0.00000 0.00000 ; H2N-terminus 2948 … CT_2 NT 3 3.33465 -1.55226 2.82001 -4.60240 0.00000 0.00000 ; H2N-terminus 2953 … CT_2 NT 3 3.33465 -1.55226 2.82001 -4.60240 0.00000 0.00000 ; H2N-terminus 2956 … CT_2 NT 3 3.33465 -1.55226 2.82001 -4.60240 0.00000 0.00000 ; H2N-terminus 2961 … CT_2 NT 3 3.33465 -1.55226 2.82001 -4.60240 0.00000 0.00000 ; H2N-terminus [all …]
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H A D | out.reference | 3268 …2 NT H 3 -1.26775 3.02085 1.74473 -3.49782 0.00000 0.00000 ; H2N-terminus 3424 … CT_2 HC 3 0.83680 2.51040 0.00000 -3.34720 0.00000 0.00000 ; H2N-terminus 3471 … CT_2 NT 3 -4.09614 5.08775 2.96645 -3.95806 0.00000 0.00000 ; H2N-terminus 3544 …2 C O 3 0.00000 0.00000 0.00000 0.00000 0.00000 0.00000 ; H2N-terminus 3545 …2 CT S 3 3.40787 -2.80537 -0.35982 -0.24267 0.00000 0.00000 ; H2N-terminus 3546 …2 CT SH 3 3.40787 -2.80537 -0.35982 -0.24267 0.00000 0.00000 ; H2N-terminus 3761 … CT_2 NT 3 3.33465 -1.55226 2.82001 -4.60240 0.00000 0.00000 ; H2N-terminus 3766 … CT_2 NT 3 3.33465 -1.55226 2.82001 -4.60240 0.00000 0.00000 ; H2N-terminus 3769 … CT_2 NT 3 3.33465 -1.55226 2.82001 -4.60240 0.00000 0.00000 ; H2N-terminus 3774 … CT_2 NT 3 3.33465 -1.55226 2.82001 -4.60240 0.00000 0.00000 ; H2N-terminus [all …]
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/dports/science/plumed/plumed2-2.7.2/regtest/basic/rt-hrex-4/ |
H A D | processed.top | 1412 22 H_ 2 4YB H2N 22 0.3000 1.008 1441 49 H_ 3 4YB H2N 49 0.3000 1.008 1515 117 H_ 6 4YB H2N 117 0.3000 1.008 1629 223 H 10 4YB H2N 223 0.3000 1.008
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H A D | out.reference | 1493 22 H_ 2 4YB H2N 22 0.212132 1.008 1522 49 H_ 3 4YB H2N 49 0.212132 1.008 1596 117 H_ 6 4YB H2N 117 0.212132 1.008 1710 223 H 10 4YB H2N 223 0.3000 1.008
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/dports/science/gromacs/gromacs-2021.4/share/top/oplsaa.ff/ |
H A D | atomtypes.atp | 735 opls_751 14.00670 ; N2 of neutral ARG (H2N-CZ)
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/dports/science/py-pymol/pymol-open-source-2.4.0/data/ |
H A D | chem_comp_bond-top100.cif | 1594 NAD C2N H2N SING N N 64 1699 NAP C2N H2N SING N N 64 1810 NDP C2N H2N SING N N 65
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/dports/security/vault/vault-1.8.2/vendor/github.com/keybase/go-crypto/openpgp/ |
H A D | keys_data_test.go | 2364 H2N+kt90Ut71htvi05X1ZJ0NWY9cR9spoUBgJOG8tMAOf+ta5Rb6eXdktciJcjAl
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/dports/japanese/font-kanji26/ja-font-kanji26-1.0_3/ |
H A D | kanji26.al | 575 MQH=&1"T0(9[ /8<H\'=H"FQ5J2)8@1/%$H2N@X\8_LL%=O^"!,' ^AU,L4\X
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/dports/chinese/dictd-database/dict-zh-1.6/ |
H A D | netterm.index | 1626 duality H2N S
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/dports/science/jmol/jmol-14.32.7/src/org/jmol/minimize/forcefield/mmff/validate/ |
H A D | mmff-validation.dat | 2372 …5 23 C1N #16 1 H2K #17 5 H3K #18 5 H4K #19 5 H2E #20 5 H3E #21 5 H4E #22 5 H2N #23 5 H3N #24 5 H4N… 2373 …N #16 CR H2K #17 HC H3K #18 HC H4K #19 HC H2E #20 HC H3E #21 HC H4E #22 HC H2N #23 HC H3N #24 HC H… 2374 ….000 H3K #18 0.000 H4K #19 0.000 H2E #20 0.000 H3E #21 0.000 H4E #22 0.000 H2N #23 0.000 H3N #24 0… 2375 ….000 H3K #18 0.000 H4K #19 0.000 H2E #20 0.000 H3E #21 0.000 H4E #22 0.000 H2N #23 0.000 H3N #24 0…
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/dports/comms/yfklog/yfklog-0.6.0/ |
H A D | cty.dat | 208 3H2I[33],3H2J[33],3H2K[33],3H2L[33],3H2M[33],3H2N[33],3H2O[33],3H2P[33],3I2I[33],3I2J[33],
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/dports/comms/wsjtz/wsjtx/ |
H A D | cty.dat | 214 3H2I[33],3H2J[33],3H2K[33],3H2L[33],3H2M[33],3H2N[33],3H2O[33],3H2P[33],3I2I[33],3I2J[33],
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/dports/www/py-notebook/notebook-6.4.5/tools/tests/ |
H A D | CSS Reference.ipynb | 772 "H2N+SD4qgxq6kAPbRoYrHEMow5mAmV9O3t8K2YcCSDSiWFP2CJCBfH4V5mDTh85Z+vHIYFgCxApA\n",
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/dports/games/xnethack/xNetHack-xnh6.1/outdated/sys/mac/ |
H A D | NHsound.hqx | 3888 [LUPmDBU(E@q1MB5%GAk'I(D#N!"rG(Z#KBH!Hi0rGRQ(MSL!FhL(H(H2N!"rGi"
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/dports/games/nethack33/nethack-3.3.1/sys/mac/ |
H A D | NHsound.hqx | 3888 [LUPmDBU(E@q1MB5%GAk'I(D#N!"rG(Z#KBH!Hi0rGRQ(MSL!FhL(H(H2N!"rGi"
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/dports/games/nethack33-nox11/nethack-3.3.1/sys/mac/ |
H A D | NHsound.hqx | 3888 [LUPmDBU(E@q1MB5%GAk'I(D#N!"rG(Z#KBH!Hi0rGRQ(MSL!FhL(H(H2N!"rGi"
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