Research Article

QSPR Modeling of Fungicides Using Topological Descriptors

Table 12

Standard error of estimate.

Topological indicesStandard error of estimate
Solubility in waterBoiling pointDensityMelting pointMolar MassFlash pointTopological polar surface areaHeavy atom countComplexityRefractive index

ABC(G)90.341742.79130.07552651.372315.3851525.864715.02410.42538.7830.044068
RA(G)90.141542.58200.07617351.565215.5850325.738415.16810.30840.6820.045658
M1(G)89.911043.06040.07288651.241414.5736326.026515.09520.58834.9840.041146
M2(G)89.425943.40310.07259151.177914.6504626.233115.26730.75632.9020.039002
HM(G)88.970343.34500.07371650.892514.1007826.198115.05220.77432.2150.038999
H(G)90.165142.63300.07514351.527915.9434825.768915.32460.36640.8410.045334
SCI(G)90.312742.71150.07414451.564015.5866325.816215.25600.36139.4010.044396
F(G)88.489143.32930.07586750.557113.9869926.188814.80490.84132.7380.039441
GA(G)90.339842.86830.07286251.554815.6153825.910615.31960.45638.3270.043184