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The Thermodynamics of Anion Complexation to Nonpolar Pockets.
Sullivan MR, Yao W, Tang D, Ashbaugh HS, Gibb BC. Sullivan MR, et al. Among authors: yao w. J Phys Chem B. 2018 Feb 8;122(5):1702-1713. doi: 10.1021/acs.jpcb.7b12259. Epub 2018 Jan 26. J Phys Chem B. 2018. PMID: 29373793 Free PMC article.
Overview of the SAMPL6 host-guest binding affinity prediction challenge.
Rizzi A, Murkli S, McNeill JN, Yao W, Sullivan M, Gilson MK, Chiu MW, Isaacs L, Gibb BC, Mobley DL, Chodera JD. Rizzi A, et al. Among authors: yao w. J Comput Aided Mol Des. 2018 Oct;32(10):937-963. doi: 10.1007/s10822-018-0170-6. Epub 2018 Nov 10. J Comput Aided Mol Des. 2018. PMID: 30415285 Free PMC article.
Bright G-Quadruplex Nanostructures Functionalized with Porphyrin Lanterns.
Pathak P, Yao W, Hook KD, Vik R, Winnerdy FR, Brown JQ, Gibb BC, Pursell ZF, Phan AT, Jayawickramarajah J. Pathak P, et al. Among authors: yao w. J Am Chem Soc. 2019 Aug 14;141(32):12582-12591. doi: 10.1021/jacs.9b03250. Epub 2019 Aug 1. J Am Chem Soc. 2019. PMID: 31322869 Free PMC article.
Electrostatic Potential Field Effects on Amine Macrocyclizations within Yoctoliter Spaces: Supramolecular Electron Withdrawing/Donating Groups.
Yao W, Wang K, Ismaiel YA, Wang R, Cai X, Teeler M, Gibb BC. Yao W, et al. J Phys Chem B. 2021 Aug 19;125(32):9333-9340. doi: 10.1021/acs.jpcb.1c05238. Epub 2021 Aug 6. J Phys Chem B. 2021. PMID: 34355901 Free PMC article.
C. J. Am. Chem. Soc. 2020, 142, 8291-8298; Wang, K.; Cai, X.; Yao, W.; Tang, D.; Kataria, R.; Ashbaugh, H. S.; Byers, L. D.; Gibb, B. ...
C. J. Am. Chem. Soc. 2020, 142, 8291-8298; Wang, K.; Cai, X.; Yao, W.; Tang, D.; Kataria, R.; Ashbaugh, H. S.; Byers, L. D.; G …
6,030 results