Roman M Balabin


AuthID: R-00M-1KT

Confirmed Publications: 64



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TITLE: Support vector machine regression (LS-SVM)an alternative to artificial neural networks (ANNs) for the analysis of quantum chemistry data  Full Text
AUTHORS: Balabin, Roman M. ; Ekaterina I Lomakina;
PUBLISHED: 2011, SOURCE: Physical Chemistry Chemical Physics, VOLUME: 13, ISSUE: 24
INDEXED IN: Scopus CrossRef: 172
IN MY: ORCID
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TITLE: The keto-enol equilibrium in substituted acetaldehydes: Focal-point analysis and ab initio limit  Full Text
AUTHORS: Balabin, Roman M. ;
PUBLISHED: 2011, SOURCE: Molecular Physics, VOLUME: 109, ISSUE: 19
INDEXED IN: Scopus CrossRef: 2
IN MY: ORCID
24
TITLE: Variable selection in near-infrared spectroscopy: Benchmarking of feature selection methods on biodiesel data  Full Text
AUTHORS: Balabin, Roman M. ; Sergey V Smirnov;
PUBLISHED: 2011, SOURCE: Analytica Chimica Acta, VOLUME: 692, ISSUE: 1-2
INDEXED IN: Scopus CrossRef: 333
IN MY: ORCID
25
TITLE: What happens to hydrophobic interactions during transfer from the solution to the gas phase? The case of electrospray-based soft ionization methods
AUTHORS: Konstantin Barylyuk; Balabin, Roman M. ; Dan Grünstein; Raghavendra Kikkeri; Vladimir Frankevich; Peter H Seeberger; Renato Zenobi;
PUBLISHED: 2011, SOURCE: Journal of the American Society for Mass Spectrometry, VOLUME: 22, ISSUE: 7
INDEXED IN: Scopus CrossRef: 45
IN MY: ORCID
26
TITLE: Boryl substitution of acetaldehyde makes it an enol: Inconsistency between Gn/CBS and Ab initio/DFT data
AUTHORS: Balabin, Roman M. ;
PUBLISHED: 2010, SOURCE: Journal of Physical Chemistry A, VOLUME: 114, ISSUE: 10
INDEXED IN: Scopus CrossRef: 18
IN MY: ORCID
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TITLE: Communications: Is quantum chemical treatment of biopolymers accurate? Intramolecular basis set superposition error (BSSE)  Full Text
AUTHORS: Balabin, Roman M. ;
PUBLISHED: 2010, SOURCE: Journal of Chemical Physics, VOLUME: 132, ISSUE: 23
INDEXED IN: Scopus CrossRef: 38
IN MY: ORCID
29
TITLE: Conformational equilibrium in glycine: Experimental jet-cooled Raman spectrum  Full Text
AUTHORS: Balabin, Roman M. ;
PUBLISHED: 2010, SOURCE: Journal of Physical Chemistry Letters, VOLUME: 1, ISSUE: 1
INDEXED IN: Scopus CrossRef: 88
IN MY: ORCID
30
TITLE: Direct Access to Isolated Biomolecules under Ambient Conditions
AUTHORS: Konstantin Chingin; Vladimir Frankevich; Balabin, Roman M. ; Konstantin Barylyuk; Huanwen Chen; Rui Wang; Renato Zenobi;
PUBLISHED: 2010, SOURCE: Angewandte Chemie - International Edition, VOLUME: 49, ISSUE: 13
INDEXED IN: Scopus
IN MY: ORCID
Page 3 of 7. Total results: 64.

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