P34518, P30737, P30565/FWF Austrian Science Fund[Grants and Funding] - Search Results

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Nanobody Paratope Ensembles in Solution Characterized by MD Simulations and NMR.

Fernández-Quintero ML, DeRose EF, Gabel SA, Mueller GA, Liedl KR. Fernández-Quintero ML, et al. Int J Mol Sci. 2022 May 12;23(10):5419. doi: 10.3390/ijms23105419. Int J Mol Sci. 2022. PMID: 35628231 Free PMC article.

Explicit solvation thermodynamics in ionic solution: extending grid inhomogeneous solvation theory to solvation free energy of salt-water mixtures.

Waibl F, Kraml J, Fernández-Quintero ML, Loeffler JR, Liedl KR. Waibl F, et al. J Comput Aided Mol Des. 2022 Feb;36(2):101-116. doi: 10.1007/s10822-021-00429-y. Epub 2022 Jan 15. J Comput Aided Mol Des. 2022. PMID: 35031880 Free PMC article.

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