Bowman GR - Search Results

1

Open science discovery of potent noncovalent SARS-CoV-2 main protease inhibitors.

Boby ML, Fearon D, Ferla M, Filep M, Koekemoer L, Robinson MC; COVID Moonshot Consortium‡; Chodera JD, Lee AA, London N, von Delft A, von Delft F, Achdout H, Aimon A, Alonzi DS, Arbon R, Aschenbrenner JC, Balcomb BH, Bar-David E, Barr H, Ben-Shmuel A, Bennett J, Bilenko VA, Borden B, Boulet P, Bowman GR, Brewitz L, Brun J, Bvnbs S, Calmiano M, Carbery A, Carney DW, Cattermole E, Chang E, Chernyshenko E, Clyde A, Coffland JE, Cohen G, Cole JC, Contini A, Cox L, Croll TI, Cvitkovic M, De Jonghe S, Dias A, Donckers K, Dotson DL, Douangamath A, Duberstein S, Dudgeon T, Dunnett LE, Eastman P, Erez N, Eyermann CJ, Fairhead M, Fate G, Fedorov O, Fernandes RS, Ferrins L, Foster R, Foster H, Fraisse L, Gabizon R, García-Sastre A, Gawriljuk VO, Gehrtz P, Gileadi C, Giroud C, Glass WG, Glen RC, Glinert I, Godoy AS, Gorichko M, Gorrie-Stone T, Griffen EJ, Haneef A, Hassell Hart S, Heer J, Henry M, Hill M, Horrell S, Huang QYJ, Huliak VD, Hurley MFD, Israely T, Jajack A, Jansen J, Jnoff E, Jochmans D, John T, Kaminow B, Kang L, Kantsadi AL, Kenny PW, Kiappes JL, Kinakh SO, Kovar B, Krojer T, La VNT, Laghnimi-Hahn S, Lefker BA, Levy H, Lithgo RM, Logvinenko IG, Lukacik P, Macdonald HB, M… See abstract for full author list ➔ Boby ML, et al. Among authors: bowman gr. Science. 2023 Nov 10;382(6671):eabo7201. doi: 10.1126/science.abo7201. Epub 2023 Nov 10. Science. 2023. PMID: 37943932 Free PMC article.

2

Folding@home: Achievements from over 20 years of citizen science herald the exascale era.

Voelz VA, Pande VS, Bowman GR. Voelz VA, et al. Among authors: bowman gr. Biophys J. 2023 Jul 25;122(14):2852-2863. doi: 10.1016/j.bpj.2023.03.028. Epub 2023 Mar 21. Biophys J. 2023. PMID: 36945779 Free article. Review.

3

Folding@home: achievements from over twenty years of citizen science herald the exascale era.

Voelz VA, Pande VS, Bowman GR. Voelz VA, et al. Among authors: bowman gr. ArXiv [Preprint]. 2023 Mar 15:arXiv:2303.08993v1. ArXiv. 2023. PMID: 36994157 Free PMC article. Updated. Preprint.

4

Discovery of a cryptic pocket in the AI-predicted structure of PPM1D phosphatase explains the binding site and potency of its allosteric inhibitors.

Meller A, De Oliveira S, Davtyan A, Abramyan T, Bowman GR, van den Bedem H. Meller A, et al. Among authors: bowman gr. Front Mol Biosci. 2023 Apr 18;10:1171143. doi: 10.3389/fmolb.2023.1171143. eCollection 2023. Front Mol Biosci. 2023. PMID: 37143823 Free PMC article.

5

Discovery of a cryptic pocket in the AI-predicted structure of PPM1D phosphatase explains the binding site and potency of its allosteric inhibitors.

Meller A, de Oliveira S, Davtyan A, Abramyan T, Bowman GR, van den Bedem H. Meller A, et al. Among authors: bowman gr. bioRxiv [Preprint]. 2023 Mar 24:2023.03.22.533829. doi: 10.1101/2023.03.22.533829. bioRxiv. 2023. PMID: 36993233 Free PMC article. Updated. Preprint.

6

PopShift: A thermodynamically sound approach to estimate binding free energies by accounting for ligand-induced population shifts from a ligand-free MSM.

Smith LG, Novak B, Osato M, Mobley DL, Bowman GR. Smith LG, et al. Among authors: bowman gr. bioRxiv [Preprint]. 2023 Aug 8:2023.07.14.549110. doi: 10.1101/2023.07.14.549110. bioRxiv. 2023. PMID: 37503302 Free PMC article. Updated. Preprint.

7

Structure-function correlates of fibrinogen binding by Acinetobacter adhesins critical in catheter-associated urinary tract infections.

Tamadonfar KO, Di Venanzio G, Pinkner JS, Dodson KW, Kalas V, Zimmerman MI, Bazan Villicana J, Bowman GR, Feldman MF, Hultgren SJ. Tamadonfar KO, et al. Among authors: bowman gr. Proc Natl Acad Sci U S A. 2023 Jan 24;120(4):e2212694120. doi: 10.1073/pnas.2212694120. Epub 2023 Jan 18. Proc Natl Acad Sci U S A. 2023. PMID: 36652481 Free PMC article.

8

Divergent Molecular Phenotypes in Point Mutations at the Same Residue in Beta-Myosin Heavy Chain Lead to Distinct Cardiomyopathies.

Lehman SJ, Meller A, Solieva SO, Lotthammer JM, Greenberg L, Langer SJ, Greenberg MJ, Tardiff JC, Bowman GR, Leinwand L. Lehman SJ, et al. Among authors: bowman gr. bioRxiv [Preprint]. 2023 Jul 3:2023.07.03.547580. doi: 10.1101/2023.07.03.547580. bioRxiv. 2023. PMID: 37461648 Free PMC article. Preprint.

9

Apolipoprotein E4 has extensive conformational heterogeneity in lipid-free and lipid-bound forms.

Stuchell-Brereton MD, Zimmerman MI, Miller JJ, Mallimadugula UL, Incicco JJ, Roy D, Smith LG, Cubuk J, Baban B, DeKoster GT, Frieden C, Bowman GR, Soranno A. Stuchell-Brereton MD, et al. Among authors: bowman gr. Proc Natl Acad Sci U S A. 2023 Feb 14;120(7):e2215371120. doi: 10.1073/pnas.2215371120. Epub 2023 Feb 7. Proc Natl Acad Sci U S A. 2023. PMID: 36749730 Free PMC article.

10

Multiple conserved states characterize the twist landscape of the bacterial actin homolog MreB.

Knapp BD, Ward MD, Bowman GR, Shi H, Huang KC. Knapp BD, et al. Among authors: bowman gr. Comput Struct Biotechnol J. 2022 Oct 7;20:5838-5846. doi: 10.1016/j.csbj.2022.10.008. eCollection 2022. Comput Struct Biotechnol J. 2022. PMID: 36382191 Free PMC article.

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