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Results 1 - 10 of 52  for Great Falls College MSU

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Structural Analysis from Classroom to Laboratory

Wist, Julien ; Patiny, Luc

Journal of Chemical Education, Jul 10, 2012, Vol.89(8), p.1083 [Peer Reviewed Journal]

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Monitoring of illicit pill distribution networks using an image collection exploration framework

Camargo, Jorge ; Esseiva, Pierre ; González, Fabio ; Wist, Julien ; Patiny, Luc

Forensic Science International, 30 November 2012, Vol.223(1-3), pp.298-305 [Peer Reviewed Journal]

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Improving the efficiency of branch-and-bound complete-search NMR assignment using the symmetry of molecules and spectra

Bernal, Andrés ; Castillo, Andrés M. ; González, Fabio ; Patiny, Luc ; Wist, Julien

The Journal of Chemical Physics, 21 February 2015, Vol.142(7) [Peer Reviewed Journal]

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Versatile Tool for the Analysis of Metal-Protein Interactions Reveals the Promiscuity of Metallodrug-Protein Interactions.

Lee, Ronald F S ; Menin, Laure ; Patiny, Luc ; Ortiz, Daniel ; Dyson, Paul J Lee, Ronald F S (correspondence author) ; Lee, Ronald F S (record owner)

Analytical chemistry, November 21, 2017, Vol.89(22), pp.11985-11989 [Peer Reviewed Journal]

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ChemCalc: a building block for tomorrow's chemical infrastructure.

Patiny, Luc ; Borel, Alain Patiny, Luc (correspondence author) ; Patiny, Luc (record owner)

Journal of chemical information and modeling, May 24, 2013, Vol.53(5), pp.1223-1228 [Peer Reviewed Journal]

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Teaching NMR spectra analysis with nmr.cheminfo.org

Patiny, Luc ; Bolaños, Alejandro ; Castillo, Andrés M. ; Bernal, Andrés ; Wist, Julien

Magnetic Resonance in Chemistry, June 2018, Vol.56(6), pp.529-534 [Peer Reviewed Journal]

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A new method for the comparison of 1 H NMR predictors based on tree-similarity of spectra

Castillo, Andrés ; Bernal, Andrés ; Patiny, Luc ; Wist, Julien

Journal of Cheminformatics, 2014, Vol.6(1), pp.1-6 [Peer Reviewed Journal]

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Fully automatic assignment of small molecules' NMR spectra without relying on chemical shift predictions.

Castillo, Andrés M ; Bernal, Andrés ; Patiny, Luc ; Wist, Julien Castillo, Andrés M (correspondence author) ; Castillo, Andrés M (record owner)

Magnetic resonance in chemistry : MRC, August 2015, Vol.53(8), pp.603-611 [Peer Reviewed Journal]

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"Ask Erno": a self-learning tool for assignment and prediction of nuclear magnetic resonance spectra

Castillo, Andres ; Bernal, Andres ; Dieden, Reiner ; Patiny, Luc ; Wist, Julien Castillo, Andres (correspondence author)

Journal of Cheminformatics, December 2016, Vol.8(1), pp.1-8 [Peer Reviewed Journal]

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"Ask Ernö": a self-learning tool for assignment and prediction of nuclear magnetic resonance spectra.

Castillo, Andrés M ; Bernal, Andrés ; Dieden, Reiner ; Patiny, Luc ; Wist, Julien Castillo, Andrés M (correspondence author) ; Castillo, Andrés M (record owner)

Journal of cheminformatics, 2016, Vol.8, p.26 [Peer Reviewed Journal]

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