Project 1 Publications

Recent Papers


Black, G. P., et al. (2019). "Analyzing a broader spectrum of endocrine active organic contaminants in sewage sludge with high resolution LC-QTOF-MS suspect screening and QSAR toxicity prediction." Environmental Science: Processes & Impacts 21(7): 1099-1114.


Middleton, & Talaugon, & Young, Thomas & Wong, & Fluharty, & Reed, & Cosby, & II, Myers. (2019). Bi-Directional Learning: Identifying Contaminants on the Yurok Indian Reservation. International Journal of Environmental Research and Public Health. 16. 3513. 10.3390/ijerph16193513. 

Amanda M. Rupiper, Frank J. Loge. Identifying and overcoming barriers to onsite non-potable water reuse in California from local stakeholder perspectives. Resources, Conservation & Recycling: X, Volume 4, 2019, 100018, ISSN 2590-289X,

Shin, Hyeong-Moo & Moschet, Christoph & Young, Thomas & Bennett, Deborah. (2019). Measured Concentrations of Consumer Product Chemicals in California House Dust: Implications for Sources, Exposure, and Toxicity Potential. Indoor Air. 30. 10.1111/ina.12607. 

Bertolani, Steve & Siegel, Justin. (2019). A new benchmark illustrates that integration of geometric constraints inferred from enzyme reaction chemistry can increase enzyme active site modeling accuracy. PLOS ONE. 14. e0214126. 10.1371/journal.pone.0214126. 

Tantillo, D. J., et al. (2019). "Computer-Aided Drug Design for Undergraduates." Journal of Chemical Education 96(5): 920-925.    

Gan, Junai & Siegel, Justin & German, Bruce. (2019). Molecular annotation of food – Towards personalized diet and precision health. Trends in Food Science & Technology. 91. 10.1016/j.tifs.2019.07.016. 

Jia, M., et al. (2019). "Switching on a Nontraditional Enzymatic Base—Deprotonation by Serine in the ent-Kaurene Synthase from Bradyrhizobium japonicum." ACS Catalysis 9(10): 8867-8871.

Reynolds, L. C., et al. (2019). "Computationally Guided Design of Dipeptidyl Peptidase-4 Inhibitors." bioRxiv: 772137.


Sharmah, A., et al. (2019). "Toward Development of Fluorescence-Quenching-Based Biosensors for Drought Stress in Plants." Analytical Chemistry 91(24): 15644-15651.

Huang, P., et al. (2019). "Design to Data for mutants of β-glucosidase B from <em>Paenibacillus polymyxa</em>: M319C, T431I, and K337D." bioRxiv: 839027.

Huang, P., et al. (2019). "Evaluating molecular modeling tools for thermal stability using an independently generated dataset." bioRxiv: 856732.

Contreras, S. C., et al. (2019). "A Benchmark for Homomeric Enzyme Active Site Structure Prediction Highlights the Importance of Accurate Modeling of Protein Symmetry." ACS Omega 4(27): 22356-22362.

Hou, C, Smith, P, Huang, J, Fell, J, Huang, P, Vater, A, Siegel, J. Design to Data for mutants of β-glucosidase B from Paenibacillus polymyxa: Q22T, W123R, F155G, Y169M, W438D, V401A. bioRxiv. 2019. 12.23.887380; doi:


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