Jeremy R. Ash

Works (7)

2019 article

4D-quantitative structure-activity relationship modeling: making a comeback

EXPERT OPINION ON DRUG DISCOVERY.

By: D. Fourches & J. Ash

Source: Web Of Science
Added: September 30, 2019

2019 journal article

Cheminformatics approach to exploring and modeling trait-associated metabolite profiles

JOURNAL OF CHEMINFORMATICS, 11.

Source: Web Of Science
Added: July 15, 2019

2019 journal article

Community assessment to advance computational prediction of cancer drug combinations in a pharmacogenomic screen

NATURE COMMUNICATIONS, 10.

By: M. Menden, D. Wang, M. Mason, B. Szalai, K. Bulusu, Y. Guan, T. Yu, J. Kang ...

Source: Web Of Science
Added: July 1, 2019

2019 review

Ion mobility spectrometry and the omics: Distinguishing isomers, molecular classes and contaminant ions in complex samples

[Review of ]. TRAC-TRENDS IN ANALYTICAL CHEMISTRY, 116, 292–299.

By: K. Burnum-Johnson, X. Zheng, J. Dodds, J. Ash, D. Fourches, C. Nicora, J. Wendler, T. Metz ...

Source: Web Of Science
Added: July 1, 2019

2018 journal article

chemmodlab: a cheminformatics modeling laboratoryR package for fitting and assessing machine learning models

JOURNAL OF CHEMINFORMATICS, 10.

By: J. Ash & J. Hughes-Oliver

Source: NC State University Libraries
Added: December 10, 2018

2017 journal article

Characterizing the chemical space of ERK2 kinase inhibitors using descriptors computed from molecular dynamics trajectories

Journal of Chemical Information and Modeling, 57(6), 1286–1299.

By: J. Ash & D. Fourches

Source: NC State University Libraries
Added: August 6, 2018

2016 journal article

TreeScaper: visualizing and extracting phylogenetic signal from sets of trees

Molecular Biology and Evolution, 33(12), 3314–3316.

By: W. Huang, G. Zhou, M. Marchand, J. Ash, D. Morris, P. Van Dooren, J. Brown, K. Gallivan, J. Wilgenbusch

Source: NC State University Libraries
Added: August 6, 2018