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Computational approaches to mapping allosteric pathways.
Feher VA, Durrant JD, Van Wart AT, Amaro RE. Feher VA, et al. Curr Opin Struct Biol. 2014 Apr;25:98-103. doi: 10.1016/j.sbi.2014.02.004. Epub 2014 Mar 22. Curr Opin Struct Biol. 2014. PMID: 24667124 Free PMC article. Review.
Molecular docking to flexible targets.
Sørensen J, Demir Ö, Swift RV, Feher VA, Amaro RE. Sørensen J, et al. Among authors: feher va. Methods Mol Biol. 2015;1215:445-69. doi: 10.1007/978-1-4939-1465-4_20. Methods Mol Biol. 2015. PMID: 25330975
D3R grand challenge 2015: Evaluation of protein-ligand pose and affinity predictions.
Gathiaka S, Liu S, Chiu M, Yang H, Stuckey JA, Kang YN, Delproposto J, Kubish G, Dunbar JB Jr, Carlson HA, Burley SK, Walters WP, Amaro RE, Feher VA, Gilson MK. Gathiaka S, et al. Among authors: feher va. J Comput Aided Mol Des. 2016 Sep;30(9):651-668. doi: 10.1007/s10822-016-9946-8. Epub 2016 Sep 30. J Comput Aided Mol Des. 2016. PMID: 27696240 Free PMC article.
39 results