Effect of Molecular Structure on the B3LYP-Computed HOMO–LUMO Gap: A Structure −Property Relationship Using Atomic Signatures by Ahmed Mohamed (628889)

“…The use of atomic Signatures as molecular descriptors successfully inferred correlations between different structural motifs and <i>E</i>_gap. The atomic fragments containing π-bonds in various aromatic compounds were found to be the most significant atomic Signatures, explaining nearly 50% of the variance in the data, with regression coefficients that decreased <i>E</i>_gap. …”

Thermodynamic parameters. by Jianqing Jia (21001506)

“…However, the insulation layer deteriorates with freeze-thaw cycles and temperature changes. These significantly impact tunnel reliability in these areas. …”

Numerical simulation model. by Jianqing Jia (21001506)

“…However, the insulation layer deteriorates with freeze-thaw cycles and temperature changes. These significantly impact tunnel reliability in these areas. …”

Reliability and failure probability. by Jianqing Jia (21001506)

“…However, the insulation layer deteriorates with freeze-thaw cycles and temperature changes. These significantly impact tunnel reliability in these areas. …”

Normality test using the Shapiro-Wilk test. by Akinaka Morii (12709672)

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IFA significantly attenuated capsule-mediated resistance to the binding of C3b and C5b-9 to bacterial surface. by Tingting Wang (123983)

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Comparison of soil moisture in different microtoporaphies (Note: Different letters in the same column indicate significant differences (P < 0.05)). by Qingping Gou (22641045)

Basic properties of asphalt at different aging times. by Yi Wang (32470)

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Transcript levels of MAPK, NIK, NLR and SA-dependent gene pathways and responsive genes. by Bulelani L. Sizani (21485746)

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Expression profile of WRKY-TFs and ROS accumulation in susceptible T200 and tolerant TME3 cassava genotypes. by Bulelani L. Sizani (21485746)

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Differentially-expressed NLR genes in susceptible T200 and tolerant TME3 genotypes infected with SACMV. by Bulelani L. Sizani (21485746)

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Temporal changes in the extraction socket. by Kohei Ijichi (21656230)

Experimental process. by Yi Wang (32470)

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SARA test results of different asphalt. by Yi Wang (32470)

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Different asphalt modeling. by Yi Wang (32470)

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Diffusion coefficients of asphalt components. by Yi Wang (32470)

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Composition of WEO Components. by Yi Wang (32470)

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WEO filtration device. by Yi Wang (32470)

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MSD simulation results in asphalt fractions. by Yi Wang (32470)

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Simulation of asphalt density. by Yi Wang (32470)

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