Using pesticide spray adjuvants to improve the physicochemical properties of pesticide liquids can effectively increase droplet deposition on target surfaces. However, there are no clear guidelines for the selection among complex and diverse adjuvants. We aimed to build a model for screening pesticide adjuvants through machine learning. In this paper, five machine learning classification models (decision tree, support vector machine, random forest, logistic regression, and naive Bayes) were developed to predict droplet deposition performance on the superhydrophobic plant leaf surfaces based on the physicochemical properties of pesticide liquids. Among these models, decision tree, support vector machine, and random forest exhibited superior performance. Significance analysis showed that adhesion, equilibrium surface tension, and contact angle are critical factors influencing droplet deposition on wheat leaves. Notably, the decision tree model, due to its simplicity and intuitiveness, is particularly suitable for field applications. Our findings provide a platform for the rapid and accurate screening of pesticide spray adjuvants by simply measuring the physicochemical properties of pesticide droplets.
| [1] |
Cao, C., Zhang, P., Cao, L., Liu, M., Song, Y., Chen, P., Huang, Q., & Han, B. (2022). Experimental and molecular dynamic simulation of droplet deposition on superhydrophobic plant leaf surfaces. Acta Physico-chimica Sinica, 38(12), 2207006–2207010.
|
| [2] |
Song, R., Wu, Y., Bao, Z., Gao, Y., Zhao, K., Zhang, S., Zhang, C., & Du, F. (2022). Machine learning to predict the interfacial behavior of pesticide droplets on hydrophobic surfaces for minimizing environmental risk. ACS Sustainable Chemistry and Engineering, 10(42), 14034–14044.
|
| [3] |
Wu, H., Jiang, K., Xu, Z., Yu, S., Peng, X., Zhang, Z., Bai, H., Liu, A., & Chai, G. (2019). Theoretical and experimental studies on the controllable pancake bouncing behavior of droplets. Langmuir, 35(52), 17000–17008.
|
| [4] |
Cao, C., Liu, M., Ma, X., Chen, Y., & Huang, Q. (2023). Enhancing droplets deposition on superhydrophobic plant leaves by bio-based surfactant: Experimental characterization and molecular dynamics simulations. Journal of Molecular Liquids, 387, 122696.
|
| [5] |
Kesterson, M. A., Luck, J. D., & Sama, M. P. (2015). Development and preliminary evaluation of a spray deposition sensing system for improving pesticide application. Sensors, 15(12), 31965–31972.
|
| [6] |
Song, Y., Cao, C., Liu, K., Huang, J., Zheng, L., Cao, L., Li, F., Zhao, P., & Huang, Q. (2020). The use of folate/zinc supramolecular hydrogels to increase droplet deposition on Chenopodium album L. leaves. ACS Sustainable Chemistry and Engineering, 8(34), 12911–12919.
|
| [7] |
Lykogianni, M., Bempelou, E., Karamaouna, F., & Aliferis, K. A. (2021). Do pesticides promote or hinder sustainability in agriculture? The challenge of sustainable use of pesticides in modern agriculture. Science of the Total Environment, 795, 148625.
|
| [8] |
Li, Z., Zhao, K., Wang, Y., Zheng, Z., Zhang, C., Gao, Y., & Du, F. (2022). Droplet splash and spread on superhydrophobic lotus leaves: Direct regulation by tuning the chain length of surfactant. Colloids and Surfaces A: Physicochemical and Engineering Aspects, 648, 129178.
|
| [9] |
Song, M., Hu, D., Zheng, X., Wang, L., Yu, Z., An, W., Na, R., Li, C., Li, N., Lu, Z., Dong, Z., Wang, Y., & Jiang, L. (2019). Enhancing droplet deposition on wired and curved superhydrophobic leaves. ACS Nano, 13(7), 7966–7974.
|
| [10] |
He, L., Ding, L., Li, B., Mu, W., Li, P., & Liu, F. (2021). Optimization strategy to inhibit droplets rebound on pathogen-modified hydrophobic surfaces. ACS Applied Materials and Interfaces, 13(32), 38018–38028.
|
| [11] |
He, L., Ding, L., Zhang, P., Li, B., Mu, W., & Liu, F. (2021). Impact of the equilibrium relationship between deposition and wettability behavior on the high-efficiency utilization of pesticides. Pest Management Science, 77(5), 2485–2493.
|
| [12] |
Ma, Y., Gao, Y., Zhao, K., Zhang, H., Li, Z., Du, F., & Hu, J. (2020). Simple, effective, and ecofriendly strategy to inhibit droplet bouncing on hydrophobic weed leaves. ACS Applied Materials and Interfaces, 12(44), 50126–50134.
|
| [13] |
Yi, M., Wu, L., Liu, L., Zhang, P., & Li, X. (2020). Research on the typical microstructures and contact angles of hydrophobic plant leaves. Micro and Nano Letters, 15(4), 250–254.
|
| [14] |
Zhou, L., Pan, S., Wang, J., & Vasilakos, A. V. (2017). Machine learning on big data: Opportunities and challenges. Neurocomputing, 237, 350–361.
|
| [15] |
Chen, F., Li, S., Guo, R., Song, F., Zhang, Y., Wang, X., Huo, X., Lv, Q., Ullah, H., Wang, G., Ma, Y., Yan, Q., & Ma, X. (2023). Meta-analysis of fecal viromes demonstrates high diagnostic potential of the gut viral signatures for colorectal cancer and adenoma risk assessment. Journal of Advanced Research, 49, 103–114.
|
| [16] |
Wuest, T., Weimer, D., Irgens, C., & Thoben, K.-D. (2016). Machine learning in manufacturing: Advantages, challenges, and applications. Production & Manufacturing Research, 4(1), 23–45.
|
| [17] |
Wu, Z., Ramsundar, B., Feinberg, E. N., Gomes, J., Geniesse, C., Pappu, A. S., Leswing, K., & Pande, V. (2018). MoleculeNet: A benchmark for molecular machine learning. Chemical Science, 9(2), 513–530.
|
| [18] |
Juez-Gil, M., Erdakov, I. N., Bustillo, A., & Pimenov, D. Y. (2019). A regression-tree multilayer-perceptron hybrid strategy for the prediction of ore crushing-plate lifetimes. Journal of Advanced Research, 18, 173–184.
|
| [19] |
Ma, L., & Sun, B. (2020). Machine learning and AI in marketing–Connecting computing power to human insights. International Journal of Research in Marketing, 37(3), 481–504.
|
| [20] |
Cerezo, M., Verdon, G., Huang, H.-Y., Cincio, L., & Coles, P. J. (2022). Challenges and opportunities in quantum machine learning. Nature Computational Science, 2(9), 567–576.
|
| [21] |
Li, Z., Ma, Y., Zhao, K., Zhang, C., Gao, Y., & Du, F. (2021). Regulating droplet impact and wetting behaviors on hydrophobic weed leaves by a double-chain cationic surfactant. ACS Sustainable Chemistry and Engineering, 9(7), 2891–2901.
|
| [22] |
Bao, Z., Zeng, A., Gao, T., Gao, Y., He, Q., Huang, Y., Chou, J., Yu, L., Zhang, C., & Du, F. (2022). Controlling impact behavior on superhydrophobic surfaces for droplets of nonionic surfactants by tailoring hydrophilic chain length. Journal of Molecular Liquids, 346, 117071.
|
| [23] |
Li, Z., Li, Z., Gao, Y., Zhang, C., Zhao, K., Guo, Y., Bao, Z., Wu, T., Li, X., & Du, F. (2021). Assemblies disaggregation and diffusion dictated droplet impact and wetting behaviors on hydrophobic surface. Journal of Molecular Liquids, 339, 116826.
|
| [24] |
Song, Y., Huang, Q., Huang, G., Liu, M., Cao, L., Li, F., Zhao, P., & Cao, C. (2022). The Effects of adjuvants on the wetting and deposition of insecticide solutions on hydrophobic wheat leaves. Agronomy, 12(9), 2148.
|
| [25] |
Zhao, X., Cui, H., Wang, Y., Sun, C., Cui, B., & Zeng, Z. (2017). Development strategies and prospects of nano-based smart pesticide formulation. Journal of Agricultural and Food Chemistry, 66(26), 6504–6512.
|
| [26] |
Hua, X. Y., & Rosen, M. J. (1988). Dynamic surface tension of aqueous surfactant solutions: I. Basic paremeters. Journal of Colloid and Interface Science, 124(2), 652–659.
|
| [27] |
Filippov, L. K. (1996). On the theory of dynamic surface tension of ionic surfactant solutions, I: Diffusion-convective adsorption. Journal of Colloid and Interface Science, 182(2), 330–347.
|
| [28] |
Miller, R., Joos, P., & Fainerman, V. B. (1994). Dynamic surface and interfacial tensions of surfactant and polymer solutions. Advances in Colloid and Interface Science, 49, 249–302.
|
| [29] |
Filippov, L. K. (1994). Dynamic surface tension of aqueous surfactant solutions: 2. Diffusion-kinetic-convective controlled adsorption. Journal of Colloid and Interface Science, 164(2), 471–482.
|
| [30] |
Luo, S., Chen, Z., Dong, Z., Fan, Y., Chen, Y., Liu, B., Yu, C., Li, C., Dai, H., Li, H., Wang, Y., & Jiang, L. (2019). Uniform spread of high-speed drops on superhydrophobic surface by live-oligomeric surfactant jamming. Advanced Materials, 31(41), 1904475.
|
| [31] |
Kumari, R., & Srivastava, S. K. (2017). Machine learning: A review on binary classification. International Journal of Computer Applications, 160(7), 11–15.
|
| [32] |
Zhou, Z. H. (2021). Machine learning. Springer Nature.
|
| [33] |
Zheng, L., Cao, C., Cao, L., Chen, Z., Huang, Q., & Song, B. (2018). Bounce behavior and regulation of pesticide solution droplets on rice leaf surfaces. Journal of Agricultural and Food Chemistry, 66(44), 11560–11568.
|
| [34] |
Yu, X., Zhang, Y., Hu, R., & Luo, X. (2021). Water droplet bouncing dynamics. Nano Energy, 81, 105647.
|
| [35] |
Farris, B. R., Niang-Trost, T., Branicky, M. S., & Leonard, K. C. (2022). Evaluation of machine learning models on electrochemical CO2 reduction using human curated datasets. ACS Sustainable Chemistry and Engineering, 10(33), 10934–10944.
|
| [36] |
El Naqa, I., & Murphy, M. J. (2015). What is machine learning? Springer.
|
| [37] |
Quinlan, J. R. (1996). Learning decision tree classifiers. ACM Computing Surveys, 28(1), 71–72.
|
| [38] |
Tharwat, A. (2019). Parameter investigation of support vector machine classifier with kernel functions. Knowledge and Information Systems, 61(3), 1269–1302.
|
| [39] |
Hou, P., Jolliet, O., Zhu, J., & Xu, M. (2020). Estimate ecotoxicity characterization factors for chemicals in life cycle assessment using machine learning models. Environment International, 135, 105393.
|
| [40] |
Vallée, R., Vallée, J., Guillevin, C., Lallouette, A., Thomas, C., Rittano, G., Wager, M., Guillevin, R., & Vallée, A. (2023). Machine learning decision tree models for multiclass classification of common malignant brain tumors using perfusion and spectroscopy MRI data. Frontiers in Oncology, 13, 1089998.
|
| [41] |
Tayefi, M., Esmaeili, H., Karimian, M. S., Zadeh, A. A., Ebrahimi, M., Safarian, M., Nematy, M., Parizadeh, S. M. R., Ferns, G. A., & Ghayour-Mobarhan, M. (2017). The application of a decision tree to establish the parameters associated with hypertension. Computer Methods and Programs in Biomedicine, 139, 83–91.
|
| [42] |
Quinlan, J. R. (1986). Induction of decision trees. Machine Learning, 1, 81–106.
|
| [43] |
Mitchell, T. M. (1997). Does machine learning really work? AI Magazine, 18(3), 11. https://doi.org/10.1609/aimag.v18i3.1303
|
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2024 The Author(s). New Plant Protection published by John Wiley & Sons Australia, Ltd on behalf of Institute of Plant Protection, Chinese Academy of Agricultural Sciences.