Pyzer-Knapp EO - Search Results

1

Streaming histogram sketching for rapid microbiome analytics.

Rowe WP, Carrieri AP, Alcon-Giner C, Caim S, Shaw A, Sim K, Kroll JS, Hall LJ, Pyzer-Knapp EO, Winn MD. Rowe WP, et al. Microbiome. 2019 Mar 16;7(1):40. doi: 10.1186/s40168-019-0653-2. Microbiome. 2019. PMID: 30878035 Free PMC article.

2

Explainable AI reveals changes in skin microbiome composition linked to phenotypic differences.

Carrieri AP, Haiminen N, Maudsley-Barton S, Gardiner LJ, Murphy B, Mayes AE, Paterson S, Grimshaw S, Winn M, Shand C, Hadjidoukas P, Rowe WPM, Hawkins S, MacGuire-Flanagan A, Tazzioli J, Kenny JG, Parida L, Hoptroff M, Pyzer-Knapp EO. Carrieri AP, et al. Among authors: pyzer knapp eo. Sci Rep. 2021 Feb 25;11(1):4565. doi: 10.1038/s41598-021-83922-6. Sci Rep. 2021. PMID: 33633172 Free PMC article.

3

Accelerating molecular discovery through data and physical sciences: Applications to peptide-membrane interactions.

Cipcigan F, Carrieri AP, Pyzer-Knapp EO, Krishna R, Hsiao YW, Winn M, Ryadnov MG, Edge C, Martyna G, Crain J. Cipcigan F, et al. J Chem Phys. 2018 Jun 28;148(24):241744. doi: 10.1063/1.5027261. J Chem Phys. 2018. PMID: 29960328

4

Using human in vitro transcriptome analysis to build trustworthy machine learning models for prediction of animal drug toxicity.

Gardiner LJ, Carrieri AP, Wilshaw J, Checkley S, Pyzer-Knapp EO, Krishna R. Gardiner LJ, et al. Among authors: pyzer knapp eo. Sci Rep. 2020 Jun 12;10(1):9522. doi: 10.1038/s41598-020-66481-0. Sci Rep. 2020. PMID: 32533004 Free PMC article.

5

Combining explainable machine learning, demographic and multi-omic data to inform precision medicine strategies for inflammatory bowel disease.

Gardiner LJ, Carrieri AP, Bingham K, Macluskie G, Bunton D, McNeil M, Pyzer-Knapp EO. Gardiner LJ, et al. Among authors: pyzer knapp eo. PLoS One. 2022 Feb 23;17(2):e0263248. doi: 10.1371/journal.pone.0263248. eCollection 2022. PLoS One. 2022. PMID: 35196350 Free PMC article.

6

Interpreting machine learning models to investigate circadian regulation and facilitate exploration of clock function.

Gardiner LJ, Rusholme-Pilcher R, Colmer J, Rees H, Crescente JM, Carrieri AP, Duncan S, Pyzer-Knapp EO, Krishna R, Hall A. Gardiner LJ, et al. Among authors: pyzer knapp eo. Proc Natl Acad Sci U S A. 2021 Aug 10;118(32):e2103070118. doi: 10.1073/pnas.2103070118. Proc Natl Acad Sci U S A. 2021. PMID: 34353905 Free PMC article.

7

Utilizing Machine Learning for Efficient Parameterization of Coarse Grained Molecular Force Fields.

McDonagh JL, Shkurti A, Bray DJ, Anderson RL, Pyzer-Knapp EO. McDonagh JL, et al. J Chem Inf Model. 2019 Oct 28;59(10):4278-4288. doi: 10.1021/acs.jcim.9b00646. Epub 2019 Sep 27. J Chem Inf Model. 2019. PMID: 31549507

8

Powerful, transferable representations for molecules through intelligent task selection in deep multitask networks.

Fare C , Turcani L , Pyzer-Knapp EO . Fare C , et al. Among authors: pyzer knapp eo. Phys Chem Chem Phys. 2020 Jun 21;22(23):13041-13048. doi: 10.1039/d0cp02319a. Epub 2020 Jun 1. Phys Chem Chem Phys. 2020. PMID: 32478374

9

Roughness of Molecular Property Landscapes and Its Impact on Modellability.

Aldeghi M, Graff DE, Frey N, Morrone JA, Pyzer-Knapp EO, Jordan KE, Coley CW. Aldeghi M, et al. Among authors: pyzer knapp eo. J Chem Inf Model. 2022 Oct 10;62(19):4660-4671. doi: 10.1021/acs.jcim.2c00903. Epub 2022 Sep 16. J Chem Inf Model. 2022. PMID: 36112568

10

Self-Focusing Virtual Screening with Active Design Space Pruning.

Graff DE, Aldeghi M, Morrone JA, Jordan KE, Pyzer-Knapp EO, Coley CW. Graff DE, et al. Among authors: pyzer knapp eo. J Chem Inf Model. 2022 Aug 22;62(16):3854-3862. doi: 10.1021/acs.jcim.2c00554. Epub 2022 Aug 6. J Chem Inf Model. 2022. PMID: 35938299

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