Research Article
Optimal Modeling of Anti-Breast Cancer Candidate Drugs Based on Graph Model Feature Selection
Table 1
The degree change of the minimum spanning tree of some feature nodes.
| Features | Nodes Degree_1 | Nodes Degree_0 | Nodes Degree_diff | Features | Nodes Degree_1 | Nodes Degree_0 | Nodes Degree_diff |
| nHCsatu | 190 | 23 | 167 | MDEN-11 | 142 | 33 | 109 | nG12Ring | 156 | 0 | 156 | MLFER_BH | 178 | 69 | 109 | SHCsatu | 167 | 16 | 151 | maxdNH | 140 | 31 | 109 | nHBint3 | 166 | 29 | 137 | mindNH | 139 | 31 | 108 | ETA_Shape_Y | 70 | 207 | 137 | minHdNH | 138 | 31 | 107 | maxHBd | 38 | 167 | 129 | maxaasC | 73 | 179 | 106 | SsNH2 | 158 | 29 | 129 | nBondsD2 | 211 | 106 | 105 | nsNH2 | 158 | 30 | 128 | minsCH3 | 31 | 135 | 104 | nHsNH2 | 158 | 30 | 128 | MDEN-12 | 137 | 33 | 104 | SHsNH2 | 158 | 32 | 126 | SHBint2 | 173 | 69 | 104 | ATSm1 | 158 | 33 | 125 | minHBd | 49 | 151 | 102 | SHdNH | 155 | 31 | 124 | nBase | 162 | 61 | 101 | minHCsats | 12 | 136 | 124 | minaaaC | 43 | 144 | 101 | SdNH | 154 | 31 | 123 | minHBint6 | 2 | 102 | 100 | nHdNH | 154 | 31 | 123 | SHBint8 | 156 | 57 | 99 | ndNH | 154 | 31 | 123 | SHsOH | 81 | 180 | 99 | ATSc5 | 142 | 20 | 122 | nHBint2 | 163 | 66 | 97 | nHBint7 | 157 | 37 | 120 | SsssCH | 179 | 82 | 97 | nHBint8 | 162 | 46 | 116 | SaaaC | 43 | 139 | 96 | MLFER_BO | 179 | 68 | 111 | maxsCH3 | 43 | 138 | 95 | SHBint3 | 167 | 56 | 111 | maxaaaC | 46 | 141 | 95 | ndssC | 168 | 58 | 110 | nsssCH | 194 | 100 | 94 | XLogP | 73 | 183 | 110 | minHsOH | 68 | 161 | 93 | nHBint10 | 165 | 55 | 110 | maxssssC | 96 | 4 | 92 | maxHdNH | 141 | 31 | 110 | SdO | 200 | 108 | 92 |
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