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annotate CADDSuite-1.0.1/data/QSAR/atomic_ionization_potentials.data @ 26:2f19ad95a19d

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Uploaded https://github.com/downloads/CADDSuite/main/CADDSuite_1.0.1_Linux_x86-64.tar.gz
author greg
date Tue, 15 Nov 2011 11:55:29 -0500
parents 389056b8864a
children
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389056b8864a Uploaded https://github.com/downloads/CADDSuite/main/CADDSuite_1.0.1_Linux_x86-64.tar.gz
greg
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1 # atomic ionization potentials (neutral atom and +1 ion), CRC Handbook of Chemistry and Physics, 79th edition, 1998
389056b8864a Uploaded https://github.com/downloads/CADDSuite/main/CADDSuite_1.0.1_Linux_x86-64.tar.gz
greg
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2 13.59844 20.02
389056b8864a Uploaded https://github.com/downloads/CADDSuite/main/CADDSuite_1.0.1_Linux_x86-64.tar.gz
greg
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389056b8864a Uploaded https://github.com/downloads/CADDSuite/main/CADDSuite_1.0.1_Linux_x86-64.tar.gz
greg
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4 5.39172 75.64018
389056b8864a Uploaded https://github.com/downloads/CADDSuite/main/CADDSuite_1.0.1_Linux_x86-64.tar.gz
greg
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5 9.3227 18.21116
389056b8864a Uploaded https://github.com/downloads/CADDSuite/main/CADDSuite_1.0.1_Linux_x86-64.tar.gz
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6 8.29803 25.15484
389056b8864a Uploaded https://github.com/downloads/CADDSuite/main/CADDSuite_1.0.1_Linux_x86-64.tar.gz
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7 11.26030 24.38332
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8 14.53414 29.6013
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9 13.61806 35.11730
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10 17.42282 34.97082
389056b8864a Uploaded https://github.com/downloads/CADDSuite/main/CADDSuite_1.0.1_Linux_x86-64.tar.gz
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11 21.5646 40.96328
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greg
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12 5.13908 47.2864
389056b8864a Uploaded https://github.com/downloads/CADDSuite/main/CADDSuite_1.0.1_Linux_x86-64.tar.gz
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13 7.64624 15.03528
389056b8864a Uploaded https://github.com/downloads/CADDSuite/main/CADDSuite_1.0.1_Linux_x86-64.tar.gz
greg
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14 5.98577 18.82856
389056b8864a Uploaded https://github.com/downloads/CADDSuite/main/CADDSuite_1.0.1_Linux_x86-64.tar.gz
greg
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15 8.15169 16.34585
389056b8864a Uploaded https://github.com/downloads/CADDSuite/main/CADDSuite_1.0.1_Linux_x86-64.tar.gz
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16 10.48669 19.7694
389056b8864a Uploaded https://github.com/downloads/CADDSuite/main/CADDSuite_1.0.1_Linux_x86-64.tar.gz
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17 10.36001 23.3379
389056b8864a Uploaded https://github.com/downloads/CADDSuite/main/CADDSuite_1.0.1_Linux_x86-64.tar.gz
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18 12.96764 23.814
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19 15.75962 27.62967
389056b8864a Uploaded https://github.com/downloads/CADDSuite/main/CADDSuite_1.0.1_Linux_x86-64.tar.gz
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20 4.34066 31.63
389056b8864a Uploaded https://github.com/downloads/CADDSuite/main/CADDSuite_1.0.1_Linux_x86-64.tar.gz
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21 6.11316 11.87172
389056b8864a Uploaded https://github.com/downloads/CADDSuite/main/CADDSuite_1.0.1_Linux_x86-64.tar.gz
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22 6.5615 12.79967
389056b8864a Uploaded https://github.com/downloads/CADDSuite/main/CADDSuite_1.0.1_Linux_x86-64.tar.gz
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23 6.8281 13.5755
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24 6.7463 14.66
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25 6.7665 16.4857
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26 7.43402 15.63999
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27 7.9024 16.1878
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28 7.8810 17.083
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29 7.6398 18.16884
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30 7.72638 20.29240
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31 9.3942 17.96440
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32 5.99930 20.5142
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33 7.8994 15.93462
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34 9.7886 18.633
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35 9.75238 21.19
389056b8864a Uploaded https://github.com/downloads/CADDSuite/main/CADDSuite_1.0.1_Linux_x86-64.tar.gz
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36 11.81381 21.8
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37 13.99961 24.35985
389056b8864a Uploaded https://github.com/downloads/CADDSuite/main/CADDSuite_1.0.1_Linux_x86-64.tar.gz
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38 4.17713 27.285
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39 5.6949 11.03013
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40 6.2171 12.24
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41 6.63390 13.13
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42 6.75885 14.32
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43 7.09243 16.16
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greg
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44 7.28 15.26
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45 7.36050 16.76
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46 7.45890 18.08
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47 8.3369 19.43
389056b8864a Uploaded https://github.com/downloads/CADDSuite/main/CADDSuite_1.0.1_Linux_x86-64.tar.gz
greg
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48 7.5763 21.49
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49 8.9938 16.90832
389056b8864a Uploaded https://github.com/downloads/CADDSuite/main/CADDSuite_1.0.1_Linux_x86-64.tar.gz
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50 5.78636 18.8698
389056b8864a Uploaded https://github.com/downloads/CADDSuite/main/CADDSuite_1.0.1_Linux_x86-64.tar.gz
greg
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51 7.3439 14.63225
389056b8864a Uploaded https://github.com/downloads/CADDSuite/main/CADDSuite_1.0.1_Linux_x86-64.tar.gz
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52 8.6084 16.53051
389056b8864a Uploaded https://github.com/downloads/CADDSuite/main/CADDSuite_1.0.1_Linux_x86-64.tar.gz
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53 9.0096 18.6
389056b8864a Uploaded https://github.com/downloads/CADDSuite/main/CADDSuite_1.0.1_Linux_x86-64.tar.gz
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54 10.45126 19.1313
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55 12.1298 21.20979
389056b8864a Uploaded https://github.com/downloads/CADDSuite/main/CADDSuite_1.0.1_Linux_x86-64.tar.gz
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56 3.89390 23.15745
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58 5.770 11.060
389056b8864a Uploaded https://github.com/downloads/CADDSuite/main/CADDSuite_1.0.1_Linux_x86-64.tar.gz
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59 5.5387 10.85
389056b8864a Uploaded https://github.com/downloads/CADDSuite/main/CADDSuite_1.0.1_Linux_x86-64.tar.gz
greg
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60 5.464 10.55
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61 5.5250 10.73
389056b8864a Uploaded https://github.com/downloads/CADDSuite/main/CADDSuite_1.0.1_Linux_x86-64.tar.gz
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62 5.58 10.9
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63 5.6436 11.07
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66 5.8638 11.52
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67 5.9389 11.67
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greg
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68 6.0215 11.80
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69 6.1077 11.93
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greg
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70 6.18431 12.05
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greg
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71 6.25416 12.1761
389056b8864a Uploaded https://github.com/downloads/CADDSuite/main/CADDSuite_1.0.1_Linux_x86-64.tar.gz
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72 5.4259 13.9
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73 6.82507 14.9