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David F. Grant
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2010 – 2019
- 2018
- [j7]L. Mark Hall, Dennis W. Hill
, Kelly Bugden, Shannon Cawley, Lowell H. Hall, Ming-Hui Chen, David F. Grant
:
Development of a Reverse Phase HPLC Retention Index Model for Nontargeted Metabolomics Using Synthetic Compounds. J. Chem. Inf. Model. 58(3): 591-604 (2018) - 2015
- [j6]Mai Hamdalla, Sanguthevar Rajasekaran, David F. Grant, Ion I. Mandoiu:
Metabolic Pathway Predictions for Metabolomics: A Molecular Structure Matching Approach. J. Chem. Inf. Model. 55(3): 709-718 (2015) - 2013
- [j5]Mai Hamdalla, Ion I. Mandoiu
, Dennis W. Hill
, Sanguthevar Rajasekaran, David F. Grant:
BioSM: Metabolomics Tool for Identifying Endogenous Mammalian Biochemical Structures in Chemical Structure Space. J. Chem. Inf. Model. 53(3): 601-612 (2013) - [j4]Lochana C. Menikarachchi, Dennis W. Hill, Mai Hamdalla, Ion I. Mandoiu
, David F. Grant:
In Silico Enzymatic Synthesis of a 400 000 Compound Biochemical Database for Nontargeted Metabolomics. J. Chem. Inf. Model. 53(9): 2483-2492 (2013) - 2012
- [j3]L. Mark Hall, Lowell H. Hall, Tzipporah M. Kertesz, Dennis W. Hill
, Thomas R. Sharp, Edward Z. Oblak, Ying W. Dong, David S. Wishart
, Ming-Hui Chen, David F. Grant:
Development of Ecom50 and Retention Index Models for Nontargeted Metabolomics: Identification of 1, 3-Dicyclohexylurea in Human Serum by HPLC/Mass Spectrometry. J. Chem. Inf. Model. 52(5): 1222-1237 (2012) - [c1]Mai Hamdalla, David F. Grant, Ion I. Mandoiu
, Dennis W. Hill, Sanguthevar Rajasekaran, Reda A. Ammar:
The use of graph matching algorithms to identify biochemical substructures in synthetic chemical compounds: Application to metabolomics. ICCABS 2012: 1-6
2000 – 2009
- 2009
- [j2]Daniel R. Albaugh, L. Mark Hall, Dennis W. Hill
, Tzipporah M. Kertesz, Marc Parham, Lowell H. Hall, David F. Grant:
Prediction of HPLC Retention Index Using Artificial Neural Networks and IGroup E-State Indices. J. Chem. Inf. Model. 49(4): 788-799 (2009) - 2008
- [j1]Samiran Ghosh, David F. Grant, Dipak K. Dey, Dennis W. Hill
:
A semiparametric modeling framework for potential biomarker discovery and the development of metabonomic profiles. BMC Bioinform. 9 (2008)
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