Journal of Chemical Information and Modeling

Known as: JCICS, Journal of Chemical Documentation, JCIM 
The Journal of Chemical Information and Modeling is a peer-reviewed scientific journal published by the American Chemical Society. It was established… (More)
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2016
2016
Over the past decade, the application of liquid chromatography-high resolution mass spectroscopy (LC-HRMS) has been growing… (More)
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2016
2016
Although there are several databases that contain data on many metabolites and reactions in biochemical pathways, there is still… (More)
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2016
2016
In this study we developed two-dimensional pharmacophore-based random forest models for the effective profiling of kinase… (More)
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2016
2016
The primary antioxidant activity of coumarin-chalcone hybrids has been investigated using the density functional and the… (More)
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2016
2016
UNLABELLED The prediction of hydrogen-bond (H-bond) acceptor ability is crucial in drug design. This important property is… (More)
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2015
2015
In an associated paper, we have described a reference implementation of Laplacian-corrected naïve Bayesian model building using… (More)
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2013
2013
Earlier (Kireeva et al. Mol. Inf. 2012, 31, 301-312), we demonstrated that generative topographic mapping (GTM) can be… (More)
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2013
2013
Protein-protein interactions (PPIs) play a crucial role in cellular function and form the backbone of almost all biochemical… (More)
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2013
2013
The formation of ligand-protein complexes requires simultaneous adaptation of the binding partners. In structure based virtual… (More)
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Review
2010
Review
2010
As Agrafiotis et al. note, “Chemoinformatics is a vast discipline, standing on the interface of chemistry, biology, and computer… (More)
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