| # | Qualités | Propriétés physico-chimiques | Score (en %) | Support | Support qualités | Support propriétés | |
|---|---|---|---|---|---|---|---|
| 1 | X% < 0.161 ou 130.15 < BAC < 133.569 ou 179.32 < MWC03 < 180.88 ou 103.091 < SRW02 < 104.667 ou 105.32 < SRW06 < 112.74 ou 59.287 < SRW08 < 61.985 ou 1.667 < MPC06 < 1.708 ou 2.35 < X2v < 2.404 ou 1412.0 < RDSQ < 1458.0 ou 7.363 < IDET < 7.6 ou 4.12 < IC3 < 4.165 ou 7.003 < IC5 < 7.218 ou 1.794 < TIC5 < 1.858 ou 8.416 < VR3_D < 8.547 ou 0.363 < VR1_X < 0.448 ou 2.658 < WiA_H2 < 2.722 ou 2.491 < H_Dt < 2.652 ou 1.133 < HyWi_Dt < 1.223 ou 0.828 < SpPosA_Dt < 0.855 ou 0.732 < SpMax_Dt ou 0.123 < SM3_Dt < 0.125 ou SM5_Dt < 0.071 ou 5.345 < Ho_D/Dt < 5.715 ou 3.087 < VR1_D/Dt < 3.096 ou 2.222 < SpAD_Dz(Z) < 2.379 |
96.88 | 1555 | 1576 | 1584 | ||
| 2 | 19.224 < Sp ou nR05 = 1.0 ou 46.2 < MWC03 < 55.52 ou 36.727 < SRW02 < 41.273 ou 23.661 < SRW04 < 24.433 ou 4.95 < MPC02 < 5.367 ou MPC04 = 1.778 ou 1.639 < MPC06 < 1.729 ou 668.0 < X4sol < 734.0 ou 7.377 < IDE < 7.416 ou 2.337 < IC1 < 2.6 ou 4.81 < IC5 < 5.042 ou 18.482 < TIC1 < 20.087 ou 1.021 < BIC3 < 1.028 ou 0.483 < VR1_X < 0.52 ou 0.464 < SM2_H2 < 0.49 ou 0.1 < VR1_H2 < 0.106 ou SpMax_Dt < 0.558 ou 3.55 < SM2_D/Dt < 3.59 ou SM3_Dz(Z) < 0.677 et 36.97 < MWC05 ou 60.04 < SRW06 < 62.52 ou 0.687 < SpAD_H2 < 0.713 |
96.19 | 1544 | 1545 | 1604 | ||
| 3 | X% < 0.196 ou 36.727 < SRW02 < 70.727 ou 59.651 < SRW04 < 62.641 ou 178.42 < SRW06 < 188.36 ou 41.923 < SRW08 < 72.392 ou 1.836 < piPC08 < 1.895 ou 1.173 < CID < 1.179 ou 50.514 < X2 < 50.884 ou 14.875 < X4v < 15.432 ou 906.0 < IAC < 1024.0 ou 6.907 < IDET < 7.114 ou 0.224 < HDcpx < 0.232 ou 1.727 < IC1 < 1.732 ou 8.007 < SIC3 < 8.212 ou 3.706 < BIC1 < 4.058 ou 8.09 < Chi_D < 8.268 ou 8.796 < SpPosLog_D < 9.086 ou 1.219 < VE2_X ou 0.797 < SpAD_H2 < 0.866 ou 2.214 < ChiA_Dt < 2.245 ou 0.507 < SpPosA_Dt < 0.563 ou 0.097 < SM3_Dt < 0.102 ou 24.931 < J_D/Dt < 29.241 ou SpPos_Dz(Z) < 0.808 ou 1.037 < VE1_Dz(Z) < 1.099 |
95.26 | 1529 | 1575 | 1559 | ||
| 4 | nHet = 12.0 ou 1.9 < D/Dtr09 < 5.7 ou 147.736 < BAC < 164.15 ou 174.46 < SRW06 < 179.92 ou 210.748 < SRW08 < 217.813 ou 5.921 < X0A < 5.957 ou 186.0 < X1MulPer < 196.0 ou 7.532 < IDDE < 7.833 ou 4.735 < IC3 < 4.782 ou 13.68 < IC5 < 15.183 ou 4.76 < BIC1 < 4.796 ou 2.171 < BIC3 < 2.235 ou 7.372 < AVS_D < 7.397 ou 10.857 < SpPosLog_D < 10.976 ou SpMaxA_X < 4.156 ou 4.868 < SM4_X < 4.89 ou 6.661 < SM6_X < 6.724 ou 1.163 < VE2_X < 1.221 ou 3.577 < SM2_D/Dt < 3.888 ou 1.85 < SpPos_Dz(Z) < 1.906 |
94.95 | 1524 | 1537 | 1592 | ||
| 5 | 33.723 < Mv < 34.821 ou 12.667 < SRW10 < 14.667 ou 1.441 < CID < 1.487 ou 235.0 < X2Av < 247.0 ou 4740.0 < X4sol < 4967.0 ou 317.0 < X1MulPer < 357.0 ou 11.961 < IDDE < 12.722 ou 4.569 < IDET < 5.204 ou 0.111 < Vindex < 0.114 ou 0.058 < Yindex < 0.06 ou 1.959 < IC1 ou 7.733 < IC5 < 8.637 ou 12.117 < SIC1 < 12.259 ou 3.797 < SpMaxA_X < 3.923 ou 4.948 < SpAD_X < 5.16 ou 0.121 < VR1_H2 < 0.124 ou 2.798 < H_Dt < 3.152 ou 7.053 < SpAD_D/Dt < 7.086 ou 4.761 < Ho_D/Dt < 4.845 ou VR1_D/Dt < 3.131 ou 1.004 < VE1_Dz(Z) < 1.112 |
93.02 | 1493 | 1513 | 1585 | ||
| 6 | 35.1 < D/Dtr07 < 35.5 ou 122.632 < MWC05 < 130.038 ou 130.2 < SRW06 < 132.8 ou MPC10 = 32.0 ou 7.353 < X0v < 7.941 ou 769.0 < X2sol < 816.0 ou 3.872 < IDDE < 4.031 ou 0.152 < Vindex < 0.156 ou 2.001 < IC1 < 3.505 ou 34.0 < TIC3 < 35.417 ou 7.836 < SIC3 < 7.928 ou 2.157 < ChiA_Dt < 2.235 ou 0.283 < SpMAD_Dt < 0.29 ou SpPos_Dz(Z) < 1.661 ou 1.996 < VE1_Dz(Z) < 2.126 |
90.96 | 1460 | 1466 | 1599 | ||
| 7 | 0.216 < X% < 0.222 ou 189.84 < SRW06 < 196.18 ou 56.972 < X2 < 57.087 ou 3677.0 < X4sol < 3996.0 ou 1786.0 < RDSQ < 2016.0 ou IDET < 10.461 ou 0.753 < IC1 < 1.06 ou 28.0 < TIC3 < 29.0 ou 1.911 < BIC3 < 1.992 ou 9.594 < SpPosLog_D < 9.625 ou 1.764 < HyWi_Dt < 1.805 ou 0.145 < SM3_Dt < 0.146 ou 0.027 < SM5_Dt < 0.06 ou 4.608 < Ho_D/Dt < 4.777 |
89.71 | 1440 | 1457 | 1588 | ||
| 8 | 6.062 < Sv ou 0.212 < X% < 0.234 ou 137.885 < BAC < 141.885 ou 105.06 < MWC03 < 148.71 ou 1.42 < CID < 1.43 ou 6.662 < X4 < 6.887 ou 3046.0 < X4sol < 3082.0 ou IVDE < 9.437 ou 4.103 < IC3 < 4.128 ou 12.141 < IC5 < 12.211 ou 9.594 < SpPosLog_D < 9.625 ou 0.491 < SM2_H2 < 0.501 ou 1.331 < HyWi_Dt < 1.347 ou 0.458 < SpPosA_Dt < 0.629 |
89.71 | 1440 | 1457 | 1588 | ||
| 9 | ou Hyacinth |
ZM2V < 1.0 et 0.93 < SM5_Dz(Z) < 1.034 ou 5.632 < Sv < 5.661 ou 0.242 < X% ou 147.5 < MWC03 < 150.69 ou 5.838 < IDET < 6.014 ou 1.711 < IC1 < 1.744 ou 5.914 < SIC3 < 5.937 ou 0.341 < SM4_H2 < 0.346 ou VE2_D/Dt < 1.075 et CID < 3.149 ou 85.169 < MWC05 < 86.755 ou 573.0 < X4sol < 588.0 ou 5.848 < IC5 < 6.051 ou 6.297 < SpAD_D/Dt < 6.304 et HyWi_Dt < 5.881 ou 75.0 < X4A < 76.0 |
83.95 | 1345 | 1349 | 1598 | |
| 10 | ou Jasmin |
VR1_X < 2.484 et 0.479 < SM2_H2 < 0.484 ou RFD < 8.0 ou 51.543 < MWC01 < 53.867 ou 57.987 < SRW04 < 61.648 ou 81.0 < X4A < 86.0 ou 4054.0 < RDSQ < 4170.0 ou 10.826 < SIC3 < 11.19 ou 8.791 < J_D < 8.823 ou 0.59 < SpMax_Dt < 0.593 et PCR < 10.0 ou 1.093 < CID < 1.102 ou 5.529 < BIC1 < 5.55 ou 1.612 < BIC3 < 1.654 ou 2.714 < HyWi_Dt < 2.949 ou 0.495 < SpPosA_Dt < 0.503 |
77.1 | 1236 | 1239 | 1600 | |
| 11 | Ethereal ou |
IDDE < 5.814 ou 1.687 < IC1 < 1.771 ou 5.574 < BIC1 < 5.599 ou 7.385 < Chi_D < 7.408 ou 2.036 < HyWi_Dt < 3.223 ou 2.037 < VR2_Dz(Z) < 2.251 et X% < 0.308 ou 1.465 < ChiA_Dt < 1.525 et PHI < 19.858 ou 2.942 < IVDE < 3.342 ou 2.747 < SpPosLog_H2 < 2.832 ou SM5_Dt = 0.06 |
75.0 | 1188 | 1192 | 1580 | |
| 12 | Ethereal ou |
IDDE < 5.814 ou 1.687 < IC1 < 1.771 ou 5.574 < BIC1 < 5.599 ou 7.385 < Chi_D < 7.408 ou 2.036 < HyWi_Dt < 3.223 ou 2.037 < VR2_Dz(Z) < 2.251 et X% < 0.308 ou 1.465 < ChiA_Dt < 1.525 ou SM5_Dt = 0.06 et PHI < 19.858 ou 2.942 < IVDE < 3.342 ou 2.747 < SpPosLog_H2 < 2.832 |
75.0 | 1188 | 1192 | 1580 | |
| 13 | Vanilin | 19.403 < Mv < 19.516 ou 1.267 < VE2_X < 1.292 et 11.574 < Mp < 14.625 et 1.511 < IC3 < 3.461 ou VR3_X = 3.342 et 10.0 < D/Dtr11 et 2.949 < SpPosLog_H2 < 4.385 |
69.23 | 18 | 26 | 18 | |
| 14 | Piney | 3.1 < D/Dtr11 et VAR < 0.0 et 1.372 < IC1 < 1.846 et 0.265 < SM4_H2 < 0.332 et 1.792 < SpPos_Dz(Z) < 1.924 ou Wi_D = 6.845 et 0.064 < VR1_H2 et 4.135 < H_Dt et 0.08 < SM3_Dt ou 0.38 < HDcpx < 0.387 et 30.621 < MAXDP |
68.96 | 20 | 29 | 20 | |
| 15 | Pineapple | 1.711 < IC1 < 1.772 et 1.028 < VE2_X < 1.053 ou 3.743 < SpPos_H2 < 3.745 ou 1.943 < ChiA_Dt < 1.947 et 4.699 < X0A < 8.441 et 0.039 < SM3_Dt < 0.124 et 1.931 < VR2_Dz(Z) ou VE2_D = 7.336 ou Ho_D/Dt = 3.678 et 5.371 < Wi_D < 6.425 |
64.91 | 37 | 52 | 42 | |
| 16 | Musk | 0.208 < X2v < 0.975 et 7.823 < SpAD_D/Dt < 8.877 ou 130.0 < SRW02 < 130.545 et 5.815 < SIC3 < 12.964 ou 13.0 < ON0V < 14.0 et 11.597 < IDE ou IDET = 4.621 et 22.559 < TIC1 |
62.26 | 33 | 52 | 34 | |
| 17 | Sour | 0.071 < X% < 0.281 et 18.0 < IAC < 448.0 et 0.2 < HDcpx < 0.305 et 2.132 < IC1 < 3.046 ou 2.899 < BIC1 < 2.91 et 26.3 < D/Dtr07 et 8.181 < IC5 < 22.211 et 0.149 < VR1_X < 0.483 ou 0.971 < SpAD_A < 0.983 et 72.12 < MW < 244.41 et 0.096 < EE_Dt < 0.207 |
57.57 | 19 | 25 | 27 | |
| 18 | Phenolic | 0.5 < S2K < 0.75 et 1.702 < IC3 < 3.391 et 0.816 < SpAD_A < 1.461 et 0.454 < SM2_H2 < 0.483 ou 5.05 < SM4_X < 5.056 et 93.03 < SRW02 et HDcpx < 0.342 et 1.254 < IC1 < 1.953 et 0.045 < SM3_Dt < 0.062 et SM5_Dt < 0.033 |
56.66 | 17 | 24 | 23 | |
| 19 | Camphor | 0.571 < GNar < 0.8 ou 48.0 < MWC01 < 48.104 ou 4.117 < BIC1 < 4.156 ou 1.343 < SM5_Dz(Z) < 1.531 et VE2_D/Dt < 1.188 ou 529.0 < X4sol < 545.0 ou 1.667 < IVDE < 1.688 et X0sol < 1.971 et 0.223 < SpMAD_Dt ou VE1_Dt = 11.475 et 0.722 < WiA_Dz(Z) < 3.457 |
56.25 | 45 | 66 | 59 | |
| 20 | Camphor | 0.571 < GNar < 0.8 ou 4.117 < BIC1 < 4.156 ou 1.343 < SM5_Dz(Z) < 1.531 et VE2_D/Dt < 1.188 ou 48.0 < MWC01 < 48.104 ou 529.0 < X4sol < 545.0 ou 1.667 < IVDE < 1.688 et X0sol < 1.971 et 0.223 < SpMAD_Dt ou VE1_Dt = 11.475 et 0.722 < WiA_Dz(Z) < 3.457 |
56.25 | 45 | 66 | 59 | |
| 21 | Buterry ou Pineapple |
1.0 < ZM1MulPer < 2.0 et 9.061 < IC5 < 15.134 et 0.09 < EE_Dt < 0.161 et Chi_D/Dt < 0.667 ou 17.16 < X4v < 17.232 ou IDET = 9.29 ou 4.464 < BIC1 < 4.465 ou 2.337 < SpPosLog_H2 < 2.351 ou 1.943 < ChiA_Dt < 1.947 ou 0.387 < SpPosA_Dt < 0.389 ou 3.678 < Ho_D/Dt < 3.679 et 1.69 < IC1 < 2.407 et 7.912 < SpPos_D < 9.351 ou VR2_Dt = 3.009 et CIC1 < 0.045 |
55.31 | 52 | 80 | 66 | |
| 22 | Ambre ou Honey |
4.15 < SpMaxA_X < 4.844 ou 6.246 < SpMaxA_D/Dt < 7.541 et 1.588 < piPC06 < 1.826 et 0.251 < HDcpx < 0.283 ou 4.948 < IC3 < 4.999 ou 2.507 < BIC3 < 2.525 ou 8.588 < J_D < 8.591 et 9.955 < IC5 < 21.767 ou X0 = 38.0 ou 2710.0 < X4sol < 2717.0 ou 4.302 < SpPosLog_X < 4.303 ou 9.81 < VR3_H2 < 9.839 ou 0.929 < SpPosA_Dt < 0.93 ou 5.275 < SM2_D/Dt < 5.278 ou WiA_Dz(Z) = 2.459 ou 1.842 < SpPos_Dz(Z) < 1.846 et 1.0 < nCsp2 et 1.8 < D/Dtr11 < 11.5 et 1.758 < piPC08 |
55.17 | 64 | 93 | 87 | |
| 23 | Caramelic | ON0V = 5.0 ou X4Av = 8.0 et 1.056 < VE2_X < 1.296 et 2.511 < VR2_Dz(Z) ou MW = 158.22 ou 14.832 < Sp < 14.923 ou MWC09 = 220.0 et 6.149 < Sv ou 126.768 < SRW08 < 127.012 ou -0.04 < SIC5 < -0.039 ou 4.486 < Ho_X < 4.505 et 53.87 < SRW06 et 4.939 < IDE |
54.92 | 39 | 55 | 55 | |
| 24 | Creamy ou Ethereal |
2.0 < N% < 4.0 ou SpPosA_Dt < 0.399 et 0.052 < IC1 < 2.324 et SM6_X < 4.477 ou 354.413 < BAC < 394.563 et 6.3 < D/Dtr11 ou 53.752 < SRW04 < 53.765 ou 3.939 < IC3 < 3.943 ou 13.667 < TIC3 < 15.0 ou 13.651 < SpMaxA_Dz(Z) < 14.897 et nR05 < 0.0 ou 68.636 < MWC01 < 68.762 ou 175.12 < MWC03 < 175.22 ou 55.672 < SRW08 < 55.808 ou 8.158 < X0A < 8.188 ou 3669.0 < X4sol < 3693.0 ou 5.653 < IDET < 5.69 ou 0.282 < IC5 < 0.722 ou 7.675 < Chi_D < 7.678 et 0.562 < SpMax_Dt < 1.135 ou SpDiam_Dt = 0.409 et S0K < 0.578 ou 1.837 < WiA_Dz(Z) < 1.842 |
53.6 | 134 | 172 | 212 | |
| 25 | Anisic ou Ethereal |
0.479 < IC3 < 1.967 ou SpPos_X < 1.609 ou 0.256 < VR1_X < 0.316 et 0.472 < IC1 < 2.324 et ChiA_Dt < 1.539 et EE_Dt < 0.204 ou MWC01 = 60.532 ou 127.091 < SRW02 < 127.455 ou 4.609 < X0A < 4.62 ou 14.167 < TIC3 < 15.0 et nR05 < 0.0 ou 0.863 < VE2_D/Dt < 0.946 et S0K < 0.568 ou 13.651 < SpMaxA_Dz(Z) < 14.897 et 0.313 < SM4_H2 ou 3669.0 < X4sol < 3693.0 ou 12.065 < X1Mad < 12.07 ou 0.363 < IDET < 0.606 ou Ho_D/Dt = 3.678 et SNar < 0.778 et 0.564 < SpMax_Dt ou 2.0 < IC5 < 2.003 ou TIC5 = 2.833 et VE2_X < 1.31 |
53.2 | 133 | 174 | 209 | |
| 26 | Anisic ou Ethereal |
0.479 < IC3 < 1.967 ou SpPos_X < 1.609 ou 0.256 < VR1_X < 0.316 et 0.472 < IC1 < 2.324 et ChiA_Dt < 1.539 et EE_Dt < 0.204 ou MWC01 = 60.532 ou 127.091 < SRW02 < 127.455 ou 4.609 < X0A < 4.62 ou 14.167 < TIC3 < 15.0 et nR05 < 0.0 ou 0.863 < VE2_D/Dt < 0.946 et S0K < 0.568 ou 13.651 < SpMaxA_Dz(Z) < 14.897 et 0.313 < SM4_H2 ou 3669.0 < X4sol < 3693.0 ou 12.065 < X1Mad < 12.07 ou 0.363 < IDET < 0.606 ou TIC5 = 2.833 ou Ho_D/Dt = 3.678 et SNar < 0.778 et 0.564 < SpMax_Dt ou 2.0 < IC5 < 2.003 et VE2_X < 1.31 |
53.2 | 133 | 174 | 209 | |
| 27 | Balsamic ou Hay |
0.353 < S2K < 0.667 ou 4.543 < SpPos_X < 5.476 et 8.452 < IC5 < 19.568 et 1.371 < VR1_X < 3.034 ou 106.0 < BAC < 106.15 ou 60.82 < X2 < 62.297 ou 9.557 < VR3_H2 < 9.632 et NRS < 0.0 ou 251.493 < SRW08 < 254.889 et 0.052 < Yindex < 0.101 ou 7.342 < Sv < 7.384 et 3.761 < J_X ou 12.384 < SIC3 < 12.63 ou 6.44 < SpAD_D/Dt < 6.448 et 1.505 < X0sol < 3.106 ou 258.92 < SRW06 < 259.76 ou 2.042 < piPC08 < 2.053 ou 6.167 < X0v < 6.182 ou 445.0 < X4sol < 452.0 ou 4.796 < BIC1 < 4.802 ou 7.701 < Chi_D < 7.71 ou 5.182 < SpPos_H2 < 5.196 et 0.823 < CID < 1.388 ou SM4_X = 4.905 ou SpMAD_Dt = 0.167 |
52.96 | 134 | 174 | 213 | |
| 28 | Balsamic ou Hay |
0.353 < S2K < 0.667 ou 4.543 < SpPos_X < 5.476 et 8.452 < IC5 < 19.568 et 1.371 < VR1_X < 3.034 ou 60.82 < X2 < 62.297 et NRS < 0.0 ou 106.0 < BAC < 106.15 ou 251.493 < SRW08 < 254.889 ou 9.557 < VR3_H2 < 9.632 et 0.052 < Yindex < 0.101 ou 7.342 < Sv < 7.384 et 3.761 < J_X ou 12.384 < SIC3 < 12.63 ou 6.44 < SpAD_D/Dt < 6.448 et 1.505 < X0sol < 3.106 ou 258.92 < SRW06 < 259.76 ou 2.042 < piPC08 < 2.053 ou 6.167 < X0v < 6.182 ou 445.0 < X4sol < 452.0 ou 4.796 < BIC1 < 4.802 ou 7.701 < Chi_D < 7.71 ou 5.182 < SpPos_H2 < 5.196 et 0.823 < CID < 1.388 ou SM4_X = 4.905 ou SpMAD_Dt = 0.167 |
52.96 | 134 | 174 | 213 | |
| 29 | Balsamic ou Hay |
0.353 < S2K < 0.667 ou 4.543 < SpPos_X < 5.476 et 8.452 < IC5 < 19.568 et 1.371 < VR1_X < 3.034 ou 106.0 < BAC < 106.15 ou 60.82 < X2 < 62.297 ou 9.557 < VR3_H2 < 9.632 et NRS < 0.0 ou 251.493 < SRW08 < 254.889 et 0.052 < Yindex < 0.101 ou 7.342 < Sv < 7.384 et 3.761 < J_X ou 258.92 < SRW06 < 259.76 ou 12.384 < SIC3 < 12.63 ou 6.44 < SpAD_D/Dt < 6.448 et 1.505 < X0sol < 3.106 ou 2.042 < piPC08 < 2.053 ou 6.167 < X0v < 6.182 ou 445.0 < X4sol < 452.0 ou 4.796 < BIC1 < 4.802 ou 7.701 < Chi_D < 7.71 ou 5.182 < SpPos_H2 < 5.196 et 0.823 < CID < 1.388 ou SM4_X = 4.905 ou SpMAD_Dt = 0.167 |
52.96 | 134 | 174 | 213 | |
| 30 | Citrus | 40.997 < SRW04 < 50.0 et 46.85 < SpPosLog_D/Dt < 47.528 ou BIC1 = 5.982 ou 6.772 < VE2_D < 6.774 ou 0.423 < VR1_X < 0.432 ou 0.241 < EE_Dt < 0.247 et 1.114 < VE1_Dz(Z) < 1.969 ou 7.774 < IDDE < 7.779 ou 5.322 < IVDE < 5.358 ou 3788.11 < HyWi_Dz(Z) < 3879.25 et 0.509 < IC1 < 1.786 et 0.94 < VE2_D/Dt < 1.241 |
52.74 | 48 | 78 | 61 | |
| 31 | Citrus | 40.997 < SRW04 < 50.0 et 46.85 < SpPosLog_D/Dt < 47.528 ou BIC1 = 5.982 ou 6.772 < VE2_D < 6.774 ou 0.241 < EE_Dt < 0.247 et 0.893 < X2v < 1.884 ou 7.774 < IDDE < 7.779 ou 0.423 < VR1_X < 0.432 ou 1.937 < ChiA_Dt < 1.942 ou 3788.11 < HyWi_Dz(Z) < 3879.25 et 0.509 < IC1 < 1.786 et 0.204 < SpMAD_Dt < 0.355 |
52.74 | 48 | 78 | 61 | |
| 32 | Orange-blossom ou Spicy |
7.0 < ZM1MulPer ou 0.087 < VR1_H2 < 0.09 et 0.896 < SpAD_A < 1.838 ou 10.647 < SpPos_D < 10.807 et 3.6 < D/Dtr11 < 13.0 ou 18.692 < PW5 < 22.607 ou 7.762 < VE2_D < 7.797 et 0.262 < SM4_H2 < 0.327 et 0.099 < VE2_H2 < 0.145 ou 32.633 < X2 < 32.64 ou 1033.0 < X4sol < 1039.0 ou 2270.0 < RDSQ < 2279.0 ou 6.991 < SIC3 < 6.999 ou 4.981 < J_X < 5.001 ou 1.755 < SpAD_H2 < 1.766 ou 2.175 < H_Dt < 2.192 ou 0.76 < ChiA_Dt < 0.77 ou SM3_Dt = 0.168 ou 70.215 < SpPosLog_D/Dt < 70.24 ou 3.232 < Ho_D/Dt < 3.237 ou VE2_D/Dt = 1.321 et nR03 < 3.0 et PHI < 12.757 et 0.47 < S0K < 0.636 ou 153.62 < MWC03 < 153.76 |
52.42 | 119 | 158 | 188 | |
| 33 | Plum ou Rose |
D/Dtr11 < 10.0 et 4.0 < ZM1Mad < 8.0 et 0.693 < SpMAD_L < 3.091 ou 1.5 < X2v < 2.245 et 2.303 < Ho_X < 5.076 ou 2.403 < IC3 < 2.718 et 1.893 < TIC5 < 2.372 et 1.099 < SpPosLog_X < 4.586 ou 3.78 < H_Dz(Z) < 3.783 et 0.65 < SpPos_Dz(Z) < 1.64 ou 8.518 < Chi_D < 8.547 ou 8.095 < J_D < 8.096 ou 5.622 < WiA_Dt < 5.66 et SpPosA_Dt < 1.225 ou 91.048 < SRW08 < 91.5 ou 57.793 < X2 < 58.078 ou 10.958 < Chi_H2 < 10.975 ou 7.0 < SpPos_H2 < 7.043 ou 38.676 < J_D/Dt < 38.691 ou 2.593 < Ho_D/Dt < 2.594 et X% < 0.29 ou 7.628 < AVS_D < 7.632 et GNar < 0.133 et PW5 < 37.362 et 2.236 < WiA_Dz(Z) < 3.948 |
52.28 | 149 | 195 | 239 | |
| 34 | Minty | 7.899 < SIC1 < 8.521 et 5.016 < VE3_Dt < 5.109 ou 90.465 < SRW02 < 90.636 ou SRW04 = 77.983 ou IDDE = 2.297 ou 1.572 < IVDE < 1.609 ou 9.342 < VR3_D < 9.35 et ZM1MulPer < 5.0 et HDcpx < 0.392 |
51.28 | 40 | 71 | 47 | |
| 35 | Floral ou Nut |
8.328 < SpPos_D < 8.444 ou 0.078 < VR1_H2 < 0.111 ou 2.264 < AVS_D/Dt < 2.611 et 1.0 < nBnz < 4.0 et 0.349 < SpPosA_Dt < 2.219 ou 9.965 < VR3_H2 < 10.172 ou 2.845 < H_Dt < 2.938 et 0.033 < Yindex < 0.101 ou 0.912 < CID < 0.927 et 2.938 < X4v < 29.431 ou 4.81 < Sv < 4.843 ou 2238.0 < X4sol < 2311.0 ou 1068.0 < RDSQ < 1073.0 ou 7.285 < IC5 < 7.346 ou 3.956 < SpAD_X < 4.078 ou 0.995 < HyWi_Dt < 1.008 et 0.375 < SM5_Dz(Z) < 1.103 ou 252.44 < MW < 254.46 ou 47.322 < SRW04 < 47.429 ou 86.406 < SRW08 < 86.856 ou 1.342 < IC1 < 1.354 ou 2.344 < WiA_Dt < 2.358 et 1.813 < TIC5 ou 3.774 < Chi_X < 3.804 et 0.996 < VE2_D/Dt < 1.683 |
50.51 | 487 | 520 | 931 | |
| 36 | Honey | 3.841 < SpPos_X < 3.862 ou 4.15 < SpMaxA_X < 4.706 et 9.507 < IC5 < 15.272 et 0.099 < VR1_H2 < 0.106 ou 1.971 < VR1_X < 2.019 ou 14.958 < Chi_H2 < 15.079 et 0.062 < Yindex ou 1.497 < ChiA_Dt < 1.498 et 1.795 < IC1 ou SRW10 = 6.417 |
50.0 | 33 | 56 | 43 | |
| 37 | Hyacinth | 0.063 < X% et 4.219 < J_X < 4.394 et Ho_X < 3.976 et 0.034 < SM5_Dt < 0.045 ou 6.743 < SpPos_H2 < 6.805 et NRS < 0.0 et 0.27 < HDcpx < 0.322 et 1.147 < VR1_X et 0.106 < EE_Dt ou 250.0 < Psi_e_1d < 252.0 et D/Dtr05 < 55.6 et 2.046 < TIC5 |
50.0 | 19 | 31 | 26 | |
| 38 | Jasmin | 20.248 < IC5 < 21.434 ou 0.143 < VE2_H2 < 0.151 et 1.025 < IC1 < 2.098 et 0.031 < SM5_Dt < 0.085 et 2.649 < VR1_D/Dt < 3.078 ou 0.169 < Vindex < 0.17 et 2.996 < AVS_X et 3.148 < H_Dt < 4.83 et 1.252 < HyWi_Dt < 2.53 ou SpMaxA_X = 3.976 et 34.2 < D/Dtr07 < 42.9 et 0.875 < X2v < 1.289 |
50.0 | 19 | 29 | 28 | |
| 39 | Earthy ou Ethereal |
1.367 < IC1 < 1.675 ou HyWi_Dt < 0.728 et SM6_X < 4.369 et VE2_X < 1.138 ou 158.026 < SRW08 < 158.42 ou 3125.0 < XMOD < 3169.0 ou 435.0 < IAC < 443.0 ou 204.347 < ChiA_Dz(Z) < 205.185 et nR05 < 0.0 ou 6.542 < Sv < 6.587 ou 52.0 < BAC < 54.333 ou 175.12 < MWC03 < 175.22 ou 3.156 < X0sol < 3.203 ou IDE = 9.202 ou 6.956 < AVS_D < 6.961 ou 9.303 < VR3_H2 < 9.304 ou WiA_Dt = 3.96 ou 0.294 < SpPosA_Dt < 0.303 ou 2.284 < AVS_D/Dt < 2.288 ou 4.13 < SM2_D/Dt < 4.14 et VE1_Dz(Z) < 3.135 ou 290.0 < X2Av < 293.0 ou 1.92 < SpMaxA_H2 < 1.938 ou 5.101 < SpAD_D/Dt < 5.103 ou 13.51 < SpMaxA_Dz(Z) < 14.897 |
48.86 | 172 | 226 | 298 | |
| 40 | Balsamic ou Tarry |
0.545 < S2K et 0.525 < S0K < 0.572 ou 4.025 < Chi_X < 4.229 et 1.201 < IC1 < 2.924 et 1.166 < VR1_X ou 106.0 < BAC < 106.15 ou 104.987 < SRW04 < 105.661 ou 8.873 < J_D < 8.902 ou 3.237 < VR1_D/Dt < 3.254 et VE2_D/Dt < 1.39 ou 10.107 < Sp < 10.219 ou 50.05 < Psi_i_1d < 53.728 ou 247.662 < SRW08 < 254.889 ou 2016.0 < X4sol < 2035.0 ou 6.33 < SpAD_D/Dt < 6.332 et -0.007 < CIC1 < 0.044 ou 3.14 < IDDE < 3.151 ou 1.767 < IDET < 1.772 ou 3.986 < BIC1 < 3.996 ou 7.512 < AVS_D < 7.515 ou 10.509 < SpPosLog_D < 10.517 ou 3.101 < WiA_H2 < 3.103 et 0.722 < SpPos_Dz(Z) et 0.217 < SM3_Dz(Z) < 0.612 ou VR3_D/Dt = 6.451 |
48.22 | 136 | 174 | 244 | |
| 41 | Oily ou Pear |
5.636 < IDET et 0.467 < S0K < 0.541 ou 1.004 < IC1 < 1.056 et D/Dtr11 < 6.2 ou 1.151 < CID < 1.155 ou 22.363 < IC5 < 25.524 ou 0.436 < VR1_X < 0.445 ou 0.265 < SM6_H2 < 0.269 et piPC08 < 1.933 ou 43.974 < PW5 < 48.521 ou 134.959 < MWC05 < 135.513 ou 2.59 < BIC1 < 2.596 ou 4.298 < Ho_X < 4.306 ou 5.564 < VR3_D/Dt < 5.567 ou 54.213 < SM1_Dz(Z) < 54.318 et 1.01 < VE2_D/Dt < 1.462 ou 78.667 < SRW02 < 79.273 ou 4.458 < SM2_D/Dt < 4.463 ou 2.888 < SpAD_Dz(Z) < 2.889 et 0.619 < SpPos_Dz(Z) < 1.806 ou 104.42 < MWC03 < 105.84 ou 15.961 < IDDE et 5.72 < VE2_D < 7.971 ou SRW10 = 7.083 ou 10.486 < SIC1 < 10.492 |
47.76 | 214 | 255 | 407 | |
| 42 | Gassy | D/Dtr09 < 4.2 et 0.983 < IC5 < 2.889 et 3.801 < SIC1 < 9.253 ou 132.792 < MWC05 < 133.124 ou 0.91 < IVDE < 0.942 ou 0.925 < IC1 < 0.943 ou 8.095 < TIC1 < 8.197 et X0sol < 2.162 et 0.56 < SpMax_Dt < 0.791 |
47.54 | 29 | 47 | 43 | |
| 43 | Waxy | 1.8 < D/Dtr11 < 5.3 et 0.103 < Vindex < 0.121 et 1.81 < TIC5 < 2.262 et 0.209 < EE_Dt < 0.252 ou 1.192 < VE2_X < 1.194 et SpMax_Dt < 0.711 ou 2.98 < SpPosLog_H2 < 2.997 et X% < 0.297 et 2.1 < MPC06 |
47.5 | 38 | 63 | 55 | |
| 44 | Banana ou Brandy |
1.315 < BIC3 < 1.323 ou 0.252 < SM6_H2 < 0.26 et 125.471 < BAC < 153.471 et 0.127 < EE_Dt < 0.179 ou 1.678 < IC1 < 1.679 et 0.171 < VE2_H2 ou 4.134 < H_Dz(Z) < 4.136 et 3.174 < IC3 < 4.358 ou X0v = 10.0 et 1.152 < VE1_Dz(Z) |
46.55 | 27 | 48 | 37 | |
| 45 | Earthy ou Peachy |
nBnz = 2.0 ou 44.8 < D/Dtr07 < 46.9 et 0.982 < SpPosA_Dt < 1.468 ou 1.608 < VE1_Dz(Z) < 1.618 et 0.663 < IC1 < 1.785 ou 1.217 < VE2_D/Dt < 1.22 et 1.414 < piPC02 < 3.536 ou 180.51 < MWC03 < 180.87 ou 15.675 < IDDE < 16.431 ou 5.244 < IDET < 5.293 ou 6.777 < SIC3 < 6.82 ou 3.309 < H_Dt < 3.311 ou 2.45 < Ho_D/Dt < 2.455 et 1.016 < IC3 < 4.479 ou 75.335 < PW5 < 82.713 ou 23.661 < SRW04 < 23.997 ou 1320.0 < X4sol < 1321.0 et 0.571 < X2v < 2.4 et SM6_X < 8.074 et 0.163 < SpMAD_Dt < 0.338 ou 3.25 < SpPos_D/Dt < 3.262 et 1.615 < VR2_Dz(Z) ou 6.346 < BIC1 < 6.362 |
46.35 | 70 | 102 | 119 | |
| 46 | Orange | 8.769 < IDDE < 10.716 ou J_D/Dt = 39.192 et X% < 0.267 et Rbrid < 25.0 et 32.3 < D/Dtr07 < 39.1 et 2.7 < D/Dtr11 < 5.1 et 0.048 < Yindex < 0.073 ou SM4_H2 = 0.395 et 7.398 < IVDE et 1.962 < TIC5 < 2.273 |
46.34 | 19 | 32 | 28 | |
| 47 | Medicinal | 0.333 < HDcpx < 0.352 ou 4.447 < SpPos_X < 4.46 et 1.574 < VE1_Dz(Z) < 1.894 ou 108.1 < MW < 108.15 ou 198.0 < MWC09 < 199.0 et 1.592 < IC3 < 3.888 ou 6.017 < SIC3 < 6.02 et 0.806 < CID < 1.102 et 0.549 < S0K < 0.613 |
46.15 | 24 | 41 | 35 | |
| 48 | Berry ou Fatty |
1.245 < CID < 1.343 ou 0.093 < SM5_Dt < 0.128 et 0.188 < X% < 0.31 et 1.714 < IC3 < 4.57 et 0.156 < EE_Dt et 0.619 < SpPos_Dz(Z) < 1.406 ou 20.292 < PHI < 28.586 ou 101.225 < SRW08 < 102.157 ou 200.0 < IAC < 212.0 ou Wi_D = 6.308 ou 6.989 < AVS_D < 6.993 ou 4.67 < WiA_Dt < 4.671 ou 2.286 < ChiA_Dt < 2.303 ou 0.622 < SM3_Dz(Z) < 0.626 et 3.627 < X0A < 12.931 et 0.461 < SM5_Dz(Z) < 1.103 ou MWC09 = 68.0 ou 0.488 < SpPosA_Dt < 0.489 ou SM3_Dt = 0.109 et 28.6 < D/Dtr07 et 7.0 < SpMaxA_A < 53.0 |
45.92 | 124 | 157 | 237 | |
| 49 | Green et Leafy |
0.234 < SpMAD_Dt < 0.286 et 0.889 < SM5_Dz(Z) < 0.936 ou ZM2V = 2.0 ou 144.258 < SRW08 < 145.126 et 0.958 < CID < 1.321 ou 5.494 < SpAD_D/Dt < 5.495 et 1.431 < IC3 < 3.736 et TIC1 < 46.111 ou 55.019 < SM1_Dz(Z) < 55.071 et 31.0 < D/Dtr07 < 37.5 et VR2_L < 3.091 |
45.45 | 25 | 44 | 36 | |
| 50 | Green et Leafy |
0.234 < SpMAD_Dt < 0.286 et 0.889 < SM5_Dz(Z) < 0.936 ou ZM2V = 2.0 ou 144.258 < SRW08 < 145.126 et 0.958 < CID < 1.321 ou 5.494 < SpAD_D/Dt < 5.495 et 31.0 < D/Dtr07 < 37.5 et 1.431 < IC3 < 3.736 et TIC1 < 46.111 ou 55.019 < SM1_Dz(Z) < 55.071 et VR2_L < 3.091 |
45.45 | 25 | 44 | 36 | |
| 51 | Apple | 30.4 < D/Dtr07 < 31.4 et 1.48 < IC1 < 1.757 et 0.048 < SM5_Dt < 0.077 ou 30.651 < SRW04 < 31.651 ou 4.82 < BIC1 < 4.825 ou 0.691 < SM3_Dz(Z) < 0.696 et 1.027 < VE2_X < 1.099 ou 60.056 < TIC1 < 60.521 et 2.281 < WiA_Dz(Z) |
44.87 | 35 | 56 | 57 | |
| 52 | Almond ou Tobacco |
1.0 < nCsp2 et X4 < 2.944 et 6.013 < IC5 < 14.861 et 0.295 < SM4_H2 < 0.336 ou 12.5 < D/Dtr09 ou S0K = 0.532 et SpPosA_Dt < 1.022 ou 46.245 < SpPosLog_D/Dt < 46.429 ou SM5_Dz(Z) = 0.529 et 1.036 < VE2_X < 1.384 |
44.15 | 34 | 57 | 54 | |
| 53 | Almond ou Animal |
3.8 < D/Dtr09 et 15.0 < RDSQ < 1423.0 et SpMaxA_A < 10.0 ou CID = 1.076 ou 10.362 < SpPosLog_D < 10.363 ou 4.086 < H_Dz(Z) < 4.132 et S2K < 0.917 ou 16.818 < Mv < 16.862 ou 3.196 < X4 < 3.197 ou 7.054 < VR3_D/Dt < 7.087 ou 2.493 < SpAD_Dz(Z) < 2.497 ou Ho_Dz(Z) = 1.519 |
44.14 | 49 | 75 | 85 | |
| 54 | Honey ou Lilly |
1.771 < IC1 et 4.303 < J_X < 4.532 et 3.841 < SpMaxA_X < 4.523 et 1.628 < VR2_Dz(Z) < 2.67 ou 121.13 < SRW06 < 121.62 ou 416.0 < X1MulPer < 434.0 ou 9.602 < SIC3 < 9.628 ou 1.257 < HyWi_Dt < 1.26 ou 3.271 < SpPos_D/Dt < 3.275 ou 39.647 < SM6_D/Dt < 39.674 et 122.18 < MW < 284.43 et 2.0 < TIC5 < 2.848 |
43.9 | 54 | 81 | 96 | |
| 55 | Animal | 3.7 < D/Dtr09 < 8.3 ou 13.075 < SIC1 < 13.33 et 16.0 < X0Av < 67.0 et 1.176 < HyWi_Dt < 3.522 ou TPC = 12.5 et Ho_X < 5.654 ou CID = 1.076 ou 0.208 < X2v < 0.278 et 3.584 < SM6_X < 7.777 |
42.42 | 28 | 51 | 43 | |
| 56 | Apricot ou Tobacco |
1.684 < IC1 < 1.822 et 10.301 < SM2_X < 10.975 et 0.032 < SM5_Dt < 0.075 ou 2.301 < IDDE < 2.413 et 99.645 < BAC < 209.471 ou 1.251 < IDET < 1.27 et 0.59 < SM5_Dz(Z) < 0.913 ou 5.522 < WiA_Dt < 5.545 ou 2.813 < VR2_Dz(Z) < 2.815 et 1.752 < piPC08 et 0.24 < HDcpx < 0.354 et 3.314 < IC5 et 0.099 < SpPosA_Dt < 1.061 |
37.17 | 29 | 61 | 46 |
| Code | Description | Catégorie | Sous-catégorie | |
|---|---|---|---|---|
| X0v | valence connectivity index of order 0 | Connectivity indices | Kier-Hall molecular connectivity indices | |
| SM3_Dz(Z) | spectral moment of order 3 from Barysz matrix weighted by atomic number | 2D matrix-based descriptors | Barysz matrix weighted by atomic number (Dz(Z)) | |
| MWC05 | molecular walk count of order 5 | Walk and path counts | Walk counts | |
| MWC03 | molecular walk count of order 3 | Walk and path counts | Walk counts | |
| nBnz | number of benzene-like rings | Ring descriptors | Basic descriptors | |
| SpMaxA_A | normalized leading eigenvalue from adjacency matrix | 2D matrix-based descriptors | Adjacency matrix (A) | |
| MWC01 | molecular walk count of order 1 | Walk and path counts | Walk counts | |
| SpPosA_Dt | normalized spectral positive sum from detour matrix | 2D matrix-based descriptors | Detour matrix (Dt) | |
| X4Av | average valence connectivity index of order 4 | Connectivity indices | Kier-Hall molecular connectivity indices | |
| ZM2V | second Zagreb index by valence vertex degrees | Topological indices | Vertex degree-based indices | |
| SM6_H2 | spectral moment of order 6 from reciprocal squared distance matrix | 2D matrix-based descriptors | Reciprocal squared distance matrix (H2) | |
| SM5_Dz(Z) | spectral moment of order 5 from Barysz matrix weighted by atomic number | 2D matrix-based descriptors | Barysz matrix weighted by atomic number (Dz(Z)) | |
| SRW08 | self-returning walk count of order 8 | Walk and path counts | Self-returning walk counts | |
| SRW06 | self-returning walk count of order 6 | Walk and path counts | Self-returning walk counts | |
| X2Av | average valence connectivity index of order 2 | Connectivity indices | Kier-Hall molecular connectivity indices | |
| SpPos_X | spectral positive sum from chi matrix | 2D matrix-based descriptors | Chi matrix (X) | |
| SpAD_D/Dt | spectral absolute deviation from distance/detour matrix | 2D matrix-based descriptors | Distance / detour matrix (D/Dt) | |
| SRW04 | self-returning walk count of order 4 | Walk and path counts | Self-returning walk counts | |
| SRW02 | self-returning walk count of order 2 | Walk and path counts | Self-returning walk counts | |
| X0Av | average valence connectivity index of order 0 | Connectivity indices | Kier-Hall molecular connectivity indices | |
| SM1_Dz(Z) | spectral moment of order 1 from Barysz matrix weighted by atomic number | 2D matrix-based descriptors | Barysz matrix weighted by atomic number (Dz(Z)) | |
| nR05 | number of 5-membered rings | Ring descriptors | Basic descriptors | |
| Psi_e_1d | electrotopological state pseudoconnectivity index - type 1d | Topological indices | E-state indices | |
| nR03 | number of 3-membered rings | Ring descriptors | Basic descriptors | |
| PW5 | path/walk 5 - Randic shape index | Topological indices | Path/walk indices | |
| SpMaxA_D/Dt | normalized leading eigenvalue from distance/detour matrix | 2D matrix-based descriptors | Distance / detour matrix (D/Dt) | |
| SpPos_D | spectral positive sum from topological distance matrix | 2D matrix-based descriptors | Topological distance matrix (D) | |
| SpAD_H2 | spectral absolute deviation from reciprocal squared distance matrix | 2D matrix-based descriptors | Reciprocal squared distance matrix (H2) | |
| Chi_D/Dt | Randic-like index from distance/detour matrix | 2D matrix-based descriptors | Distance / detour matrix (D/Dt) | |
| SNar | Narumi simple topological index (log function) | Topological indices | Vertex degree-based indices | |
| AVS_X | average vertex sum from chi matrix | 2D matrix-based descriptors | Chi matrix (X) | |
| VE1_Dt | coefficient sum of the last eigenvector from detour matrix | 2D matrix-based descriptors | Detour matrix (Dt) | |
| SpPos_D/Dt | spectral positive sum from distance/detour matrix | 2D matrix-based descriptors | Distance / detour matrix (D/Dt) | |
| X0A | average connectivity index of order 0 | Connectivity indices | Kier-Hall molecular connectivity indices | |
| IDE | mean information content on the distance equality | Information indices | Basic descriptors | |
| Ho_Dz(Z) | Hosoya-like index (log function) from Barysz matrix weighted by atomic number | 2D matrix-based descriptors | Barysz matrix weighted by atomic number (Dz(Z)) | |
| SM2_H2 | spectral moment of order 2 from reciprocal squared distance matrix | 2D matrix-based descriptors | Reciprocal squared distance matrix (H2) | |
| Ho_X | Hosoya-like index (log function) from chi matrix | 2D matrix-based descriptors | Chi matrix (X) | |
| Ho_D/Dt | Hosoya-like index (log function) from distance/detour matrix | 2D matrix-based descriptors | Distance / detour matrix (D/Dt) | |
| VR2_L | normalized Randic-like eigenvector-based index from Laplace matrix | 2D matrix-based descriptors | Laplace matrix (L) | |
| AVS_D | average vertex sum from topological distance matrix | 2D matrix-based descriptors | Topological distance matrix (D) | |
| SpPosLog_X | logarithmic spectral positive sum from chi matrix | 2D matrix-based descriptors | Chi matrix (X) | |
| VE2_H2 | average coefficient of the last eigenvector from reciprocal squared distance matrix | 2D matrix-based descriptors | Reciprocal squared distance matrix (H2) | |
| X2sol | solvation connectivity index of order 2 | Connectivity indices | Solvation connectivity indices | |
| AVS_D/Dt | average vertex sum from distance/detour matrix | 2D matrix-based descriptors | Distance / detour matrix (D/Dt) | |
| RDSQ | reciprocal distance sum inverse Randic-like index | Connectivity indices | Randic-like connectivity indices | |
| SpPosLog_D | logarithmic spectral positive sum from topological distance matrix | 2D matrix-based descriptors | Topological distance matrix (D) | |
| PHI | Kier flexibility index | Topological indices | Path/walk indices | |
| J_D/Dt | Balaban-like index from distance/detour matrix | 2D matrix-based descriptors | Distance / detour matrix (D/Dt) | |
| SIC5 | Structural Information Content index (neighborhood symmetry of 5-order) | Information indices | Indices of neighborhood symmetry | |
| SIC3 | Structural Information Content index (neighborhood symmetry of 3-order) | Information indices | Indices of neighborhood symmetry | |
| Chi_X | Randic-like index from chi matrix | 2D matrix-based descriptors | Chi matrix (X) | |
| SIC1 | Structural Information Content index (neighborhood symmetry of 1-order) | Information indices | Indices of neighborhood symmetry | |
| IC5 | Information Content index (neighborhood symmetry of 5-order) | Information indices | Indices of neighborhood symmetry | |
| IC3 | Information Content index (neighborhood symmetry of 3-order) | Information indices | Indices of neighborhood symmetry | |
| IC1 | Information Content index (neighborhood symmetry of 1-order) | Information indices | Indices of neighborhood symmetry | |
| XMOD | modified Randic index | Connectivity indices | Randic-like connectivity indices | |
| ON0V | overall modified Zagreb index of order 0 by valence vertex degrees | Topological indices | Vertex degree-based indices | |
| Rbrid | ring bridge count | Ring descriptors | Basic descriptors | |
| VR1_H2 | Randic-like eigenvector-based index from reciprocal squared distance matrix | 2D matrix-based descriptors | Reciprocal squared distance matrix (H2) | |
| Chi_D | Randic-like index from topological distance matrix | 2D matrix-based descriptors | Topological distance matrix (D) | |
| EE_Dt | Estrada-like index (log function) from detour matrix | 2D matrix-based descriptors | Detour matrix (Dt) | |
| VE2_X | average coefficient of the last eigenvector from chi matrix | 2D matrix-based descriptors | Chi matrix (X) | |
| SpAD_X | spectral absolute deviation from chi matrix | 2D matrix-based descriptors | Chi matrix (X) | |
| H_Dz(Z) | Harary-like index from Barysz matrix weighted by atomic number | 2D matrix-based descriptors | Barysz matrix weighted by atomic number (Dz(Z)) | |
| IVDE | mean information content on the vertex degree equality | Information indices | Basic descriptors | |
| SpDiam_Dt | spectral diameter from detour matrix | 2D matrix-based descriptors | Detour matrix (Dt) | |
| VE2_D | average coefficient of the last eigenvector from topological distance matrix | 2D matrix-based descriptors | Topological distance matrix (D) | |
| SM2_D/Dt | spectral moment of order 2 from distance/detour matrix | 2D matrix-based descriptors | Distance / detour matrix (D/Dt) | |
| SpPos_H2 | spectral positive sum from reciprocal squared distance matrix | 2D matrix-based descriptors | Reciprocal squared distance matrix (H2) | |
| VR3_D/Dt | logarithmic Randic-like eigenvector-based index from distance/detour matrix | 2D matrix-based descriptors | Distance / detour matrix (D/Dt) | |
| SpAD_A | spectral absolute deviation from adjacency matrix | 2D matrix-based descriptors | Adjacency matrix (A) | |
| VE2_D/Dt | average coefficient of the last eigenvector from distance/detour matrix | 2D matrix-based descriptors | Distance / detour matrix (D/Dt) | |
| IDET | total information content on the distance equality | Information indices | Basic descriptors | |
| HyWi_Dz(Z) | hyper-Wiener-like index (log function) from Barysz matrix weighted by atomic number | 2D matrix-based descriptors | Barysz matrix weighted by atomic number (Dz(Z)) | |
| IAC | total information index on atomic composition | Information indices | Basic descriptors | |
| J_X | Balaban-like index from chi matrix | 2D matrix-based descriptors | Chi matrix (X) | |
| ZM1MulPer | first Zagreb index by multiplicative perturbation vertex degrees | Topological indices | Vertex degree-based indices | |
| RFD | ring fusion density | Ring descriptors | Basic descriptors | |
| SM6_D/Dt | spectral moment of order 6 from distance/detour matrix | 2D matrix-based descriptors | Distance / detour matrix (D/Dt) | |
| Chi_H2 | Randic-like index from reciprocal squared distance matrix | 2D matrix-based descriptors | Reciprocal squared distance matrix (H2) | |
| MPC10 | molecular path count of order 10 | Walk and path counts | Path counts | |
| SpPos_Dz(Z) | spectral positive sum from Barysz matrix weighted by atomic number | 2D matrix-based descriptors | Barysz matrix weighted by atomic number (Dz(Z)) | |
| WiA_Dz(Z) | average Wiener-like index from Barysz matrix weighted by atomic number | 2D matrix-based descriptors | Barysz matrix weighted by atomic number (Dz(Z)) | |
| H_Dt | Harary-like index from detour matrix | 2D matrix-based descriptors | Detour matrix (Dt) | |
| NRS | number of ring systems | Ring descriptors | Basic descriptors | |
| SpMaxA_Dz(Z) | normalized leading eigenvalue from Barysz matrix weighted by atomic number | 2D matrix-based descriptors | Barysz matrix weighted by atomic number (Dz(Z)) | |
| piPC08 | molecular multiple path count of order 8 | Walk and path counts | Multiple path counts | |
| D/Dtr11 | distance/detour ring index of order 11 | Ring descriptors | Basic descriptors | |
| X1MulPer | multiplicative perturbation connectivity index | Connectivity indices | Randic-like connectivity indices | |
| piPC06 | molecular multiple path count of order 6 | Walk and path counts | Multiple path counts | |
| J_D | Balaban-like index from topological distance matrix (Balaban distance connectivity index) | 2D matrix-based descriptors | Topological distance matrix (D) | |
| Mv | mean atomic van der Waals volume (scaled on Carbon atom) | Constitutional indices | Basic descriptors | |
| piPC02 | molecular multiple path count of order 2 | Walk and path counts | Multiple path counts | |
| Mp | mean atomic polarizability (scaled on Carbon atom) | Constitutional indices | Basic descriptors | |
| TIC5 | Total Information Content index (neighborhood symmetry of 5-order) | Information indices | Indices of neighborhood symmetry | |
| TIC3 | Total Information Content index (neighborhood symmetry of 3-order) | Information indices | Indices of neighborhood symmetry | |
| SpPosLog_D/Dt | logarithmic spectral positive sum from distance/detour matrix | 2D matrix-based descriptors | Distance / detour matrix (D/Dt) | |
| TIC1 | Total Information Content index (neighborhood symmetry of 1-order) | Information indices | Indices of neighborhood symmetry | |
| MPC06 | molecular path count of order 6 | Walk and path counts | Path counts | |
| X1Mad | connectivity topochemical index | Connectivity indices | Randic-like connectivity indices | |
| MPC04 | molecular path count of order 4 | Walk and path counts | Path counts | |
| MPC02 | molecular path count of order 2 (Gordon-Scantlebury index) | Walk and path counts | Path counts | |
| S2K | 2-path Kier alpha-modified shape index | Topological indices | Path/walk indices | |
| D/Dtr09 | distance/detour ring index of order 9 | Ring descriptors | Basic descriptors | |
| IDDE | mean information content on the distance degree equality | Information indices | Basic descriptors | |
| D/Dtr07 | distance/detour ring index of order 7 | Ring descriptors | Basic descriptors | |
| VR2_Dz(Z) | normalized Randic-like eigenvector-based index from Barysz matrix weighted by atomic number | 2D matrix-based descriptors | Barysz matrix weighted by atomic number (Dz(Z)) | |
| D/Dtr05 | distance/detour ring index of order 5 | Ring descriptors | Basic descriptors | |
| GNar | Narumi geometric topological index | Topological indices | Vertex degree-based indices | |
| Wi_D | Wiener-like index from topological distance matrix (Wiener index) | 2D matrix-based descriptors | Topological distance matrix (D) | |
| SM3_Dt | spectral moment of order 3 from detour matrix | 2D matrix-based descriptors | Detour matrix (Dt) | |
| MW | molecular weight | Constitutional indices | Basic descriptors | |
| SpMAD_Dt | spectral mean absolute deviation from detour matrix | 2D matrix-based descriptors | Detour matrix (Dt) | |
| WiA_H2 | average Wiener-like index from reciprocal squared distance matrix | 2D matrix-based descriptors | Reciprocal squared distance matrix (H2) | |
| ChiA_Dt | average Randic-like index from detour matrix | 2D matrix-based descriptors | Detour matrix (Dt) | |
| VE3_Dt | logarithmic coefficient sum of the last eigenvector from detour matrix | 2D matrix-based descriptors | Detour matrix (Dt) | |
| BIC3 | Bond Information Content index (neighborhood symmetry of 3-order) | Information indices | Indices of neighborhood symmetry | |
| TPC | total path count | Walk and path counts | ID numbers | |
| BIC1 | Bond Information Content index (neighborhood symmetry of 1-order) | Information indices | Indices of neighborhood symmetry | |
| N% | percentage of N atoms | Constitutional indices | Basic descriptors | |
| HyWi_Dt | hyper-Wiener-like index (log function) from detour matrix | 2D matrix-based descriptors | Detour matrix (Dt) | |
| SM4_H2 | spectral moment of order 4 from reciprocal squared distance matrix | 2D matrix-based descriptors | Reciprocal squared distance matrix (H2) | |
| PCR | ratio of multiple path count over path coun | Walk and path counts | ID numbers | |
| VE1_Dz(Z) | coefficient sum of the last eigenvector from Barysz matrix weighted by atomic number | 2D matrix-based descriptors | Barysz matrix weighted by atomic number (Dz(Z)) | |
| VR3_X | logarithmic Randic-like eigenvector-based index from chi matrix | 2D matrix-based descriptors | Chi matrix (X) | |
| X4sol | solvation connectivity index of order 4 | Connectivity indices | Solvation connectivity indices | |
| HDcpx | graph distance complexity index (log function) | Information indices | Basic descriptors | |
| VR1_X | Randic-like eigenvector-based index from chi matrix | 2D matrix-based descriptors | Chi matrix (X) | |
| S0K | Kier symmetry index | Information indices | Basic descriptors | |
| ChiA_Dz(Z) | average Randic-like index from Barysz matrix weighted by atomic number | 2D matrix-based descriptors | Barysz matrix weighted by atomic number (Dz(Z)) | |
| X4v | valence connectivity index of order 4 | Connectivity indices | Kier-Hall molecular connectivity indices | |
| VR2_Dt | normalized Randic-like eigenvector-based index from detour matrix | 2D matrix-based descriptors | Detour matrix (Dt) | |
| VR3_D | logarithmic Randic-like eigenvector-based index from topological distance matrix | 2D matrix-based descriptors | Topological distance matrix (D) | |
| SpPosLog_H2 | logarithmic spectral positive sum from reciprocal squared distance matrix | 2D matrix-based descriptors | Reciprocal squared distance matrix (H2) | |
| nHet | number of heteroatoms | Constitutional indices | Basic descriptors | |
| WiA_Dt | average Wiener-like index from detour matrix | 2D matrix-based descriptors | Detour matrix (Dt) | |
| SpAD_Dz(Z) | spectral absolute deviation from Barysz matrix weighted by atomic number | 2D matrix-based descriptors | Barysz matrix weighted by atomic number (Dz(Z)) | |
| VAR | variation | Topological indices | Distance-based indices | |
| X4 | connectivity index of order 4 | Connectivity indices | Kier-Hall molecular connectivity indices | |
| Yindex | Balaban Y index | Information indices | Basic descriptors | |
| X2 | connectivity index of order 2 | Connectivity indices | Kier-Hall molecular connectivity indices | |
| VR3_H2 | logarithmic Randic-like eigenvector-based index from reciprocal squared distance matrix | 2D matrix-based descriptors | Reciprocal squared distance matrix (H2) | |
| X0 | connectivity index of order 0 | Connectivity indices | Kier-Hall molecular connectivity indices | |
| nCsp2 | number of sp2 hybridized Carbon atoms | Constitutional indices | Basic descriptors | |
| ZM1Mad | first Zagreb index by Madan vertex degrees | Topological indices | Vertex degree-based indices | |
| X0sol | solvation connectivity index of order 0 | Connectivity indices | Solvation connectivity indices | |
| X% | percentage of halogen atoms | Constitutional indices | Basic descriptors | |
| SpMax_Dt | leading eigenvalue from detour matrix | 2D matrix-based descriptors | Detour matrix (Dt) | |
| CID | Randic ID number | Walk and path counts | ID numbers | |
| CIC1 | Complementary Information Content index (neighborhood symmetry of 1-order) | Information indices | Indices of neighborhood symmetry | |
| X4A | average connectivity index of order 4 | Connectivity indices | Kier-Hall molecular connectivity indices | |
| X2v | valence connectivity index of order 2 | Connectivity indices | Kier-Hall molecular connectivity indices | |
| MAXDP | maximal electrotopological positive variation | Topological indices | E-state indices | |
| SM6_X | spectral moment of order 6 from chi matrix | 2D matrix-based descriptors | Chi matrix (X) | |
| VR1_D/Dt | Randic-like eigenvector-based index from distance/detour matrix | 2D matrix-based descriptors | Distance / detour matrix (D/Dt) | |
| SpMAD_L | spectral mean absolute deviation from Laplace matrix | 2D matrix-based descriptors | Laplace matrix (L) | |
| SM4_X | spectral moment of order 4 from chi matrix | 2D matrix-based descriptors | Chi matrix (X) | |
| SpMaxA_H2 | normalized leading eigenvalue from reciprocal squared distance matrix | 2D matrix-based descriptors | Reciprocal squared distance matrix (H2) | |
| SM2_X | spectral moment of order 2 from chi matrix | 2D matrix-based descriptors | Chi matrix (X) | |
| Psi_i_1d | intrinsic state pseudoconnectivity index - type 1d | Topological indices | E-state indices | |
| SpMaxA_X | normalized leading eigenvalue from chi matrix | 2D matrix-based descriptors | Chi matrix (X) | |
| BAC | Balaban centric index | Topological indices | Centric indices | |
| SM5_Dt | spectral moment of order 5 from detour matrix | 2D matrix-based descriptors | Detour matrix (Dt) | |
| Vindex | Balaban V index | Information indices | Basic descriptors | |
| Sv | sum of atomic van der Waals volumes (scaled on Carbon atom) | Constitutional indices | Basic descriptors | |
| SRW10 | self-returning walk count of order 10 | Walk and path counts | Self-returning walk counts | |
| Sp | sum of atomic polarizabilities (scaled on Carbon atom) | Constitutional indices | Basic descriptors | |
| MWC09 | molecular walk count of order 9 | Walk and path counts | Walk counts |