Colby SM - Search Results

1

ISiCLE: A Quantum Chemistry Pipeline for Establishing in Silico Collision Cross Section Libraries.

Colby SM, Thomas DG, Nuñez JR, Baxter DJ, Glaesemann KR, Brown JM, Pirrung MA, Govind N, Teeguarden JG, Metz TO, Renslow RS. Colby SM, et al. Anal Chem. 2019 Apr 2;91(7):4346-4356. doi: 10.1021/acs.analchem.8b04567. Epub 2019 Mar 6. Anal Chem. 2019. PMID: 30741529 Free PMC article.

2

Isolation of Tryptanthrin and Reassessment of Evidence for Its Isobaric Isostere Wrightiadione in Plants of the Wrightia Genus.

Garcellano RC, Moinuddin SGA, Young RP, Zhou M, Bowden ME, Renslow RS, Yesiltepe Y, Thomas DG, Colby SM, Chouinard CD, Nagy G, Attah IK, Ibrahim YM, Ma R, Franzblau SG, Lewis NG, Aguinaldo AM, Cort JR. Garcellano RC, et al. Among authors: colby sm. J Nat Prod. 2019 Mar 22;82(3):440-448. doi: 10.1021/acs.jnatprod.8b00567. Epub 2018 Oct 8. J Nat Prod. 2019. PMID: 30295480

3

Improving network inference algorithms using resampling methods.

Colby SM, McClure RS, Overall CC, Renslow RS, McDermott JE. Colby SM, et al. BMC Bioinformatics. 2018 Oct 12;19(1):376. doi: 10.1186/s12859-018-2402-0. BMC Bioinformatics. 2018. PMID: 30314469 Free PMC article.

4

An automated framework for NMR chemical shift calculations of small organic molecules.

Yesiltepe Y, Nuñez JR, Colby SM, Thomas DG, Borkum MI, Reardon PN, Washton NM, Metz TO, Teeguarden JG, Govind N, Renslow RS. Yesiltepe Y, et al. Among authors: colby sm. J Cheminform. 2018 Oct 26;10(1):52. doi: 10.1186/s13321-018-0305-8. J Cheminform. 2018. PMID: 30367288 Free PMC article.

5

Efficient discrimination of natural stereoisomers of chicoric acid, an HIV-1 integrase inhibitor.

Nobela O, Renslow RS, Thomas DG, Colby SM, Sitha S, Njobeh PB, du Preez L, Tugizimana F, Madala NE. Nobela O, et al. Among authors: colby sm. J Photochem Photobiol B. 2018 Dec;189:258-266. doi: 10.1016/j.jphotobiol.2018.10.025. Epub 2018 Nov 2. J Photochem Photobiol B. 2018. PMID: 30419521

6

Evaluation of In Silico Multifeature Libraries for Providing Evidence for the Presence of Small Molecules in Synthetic Blinded Samples.

Nuñez JR, Colby SM, Thomas DG, Tfaily MM, Tolic N, Ulrich EM, Sobus JR, Metz TO, Teeguarden JG, Renslow RS. Nuñez JR, et al. Among authors: colby sm. J Chem Inf Model. 2019 Sep 23;59(9):4052-4060. doi: 10.1021/acs.jcim.9b00444. Epub 2019 Aug 20. J Chem Inf Model. 2019. PMID: 31430141 Free PMC article.

7

Deep Learning to Generate in Silico Chemical Property Libraries and Candidate Molecules for Small Molecule Identification in Complex Samples.

Colby SM, Nuñez JR, Hodas NO, Corley CD, Renslow RR. Colby SM, et al. Anal Chem. 2020 Jan 21;92(2):1720-1729. doi: 10.1021/acs.analchem.9b02348. Epub 2020 Jan 6. Anal Chem. 2020. PMID: 31661259

8

Who Is Metabolizing What? Discovering Novel Biomolecules in the Microbiome and the Organisms Who Make Them.

Couvillion SP, Agrawal N, Colby SM, Brandvold KR, Metz TO. Couvillion SP, et al. Among authors: colby sm. Front Cell Infect Microbiol. 2020 Jul 31;10:388. doi: 10.3389/fcimb.2020.00388. eCollection 2020. Front Cell Infect Microbiol. 2020. PMID: 32850487 Free PMC article.

9

Computational fluid dynamics modeling of Bacillus anthracis spore deposition in rabbit and human respiratory airways.

Kabilan S, Suffield SR, Recknagle KP, Jacob RE, Einstein DR, Kuprat AP, Carson JP, Colby SM, Saunders JH, Hines SA, Teeguarden JG, Straub TM, Moe M, Taft SC, Corley RA. Kabilan S, et al. Among authors: colby sm. J Aerosol Sci. 2016 Sep;99:64-77. doi: 10.1016/j.jaerosci.2016.01.011. Epub 2016 Apr 26. J Aerosol Sci. 2016. PMID: 33311732 Free PMC article.

10

Application and assessment of deep learning for the generation of potential NMDA receptor antagonists.

Schultz KJ, Colby SM, Yesiltepe Y, Nuñez JR, McGrady MY, Renslow RS. Schultz KJ, et al. Among authors: colby sm. Phys Chem Chem Phys. 2021 Jan 21;23(2):1197-1214. doi: 10.1039/d0cp03620j. Phys Chem Chem Phys. 2021. PMID: 33355332

Save citations to file

Email citations

Send citations to clipboard

Add to Collections

Add to My Bibliography

Create a file for external citation management software

Your saved search

Your RSS Feed

My Custom Filters

Publication date

Text availability

Article attribute

Article type

Article Language

Species

Sex

Age

Other

266 results

Search Page

Filters