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Journal of Chemical Information and Modeling
|
March 6, 2014
Universal J-coupling prediction
Juuso Lehtivarjo, Matthias Niemitz, Samuli-Petrus Korhonen
Journal of Chemical Information and Computer Sciences
|
November 25, 2003
FLUFF-BALL, a template-based grid-independent superposition and QSAR technique: validation using a benchmark steroid data set
Samuli-Petrus Korhonen, Kari Tuppurainen, Reino Laatikainen, et al.
Journal of Chemical Information and Modeling
|
November 29, 2005
Comparing the performance of FLUFF-BALL to SEAL-CoMFA with a large diverse estrogen data set: from relevant superpositions to solid predictions
Samuli-Petrus Korhonen, Kari Tuppurainen, Reino Laatikainen, et al.
Journal of Biomolecular NMR
|
October 31, 2009
4D prediction of protein (1)H chemical shifts
Juuso Lehtivarjo, Tommi Hassinen, Samuli-Petrus Korhonen, et al.
Analytical and Bioanalytical Chemistry
|
April 12, 2014
Automated quantum mechanical total line shape fitting model for quantitative NMR-based profiling of human serum metabolites
Velitchka V Mihaleva, Samuli-Petrus Korhonen, John van Duynhoven, et al.
The Journal of Organic Chemistry
|
September 7, 2013
Proton fingerprints portray molecular structures: enhanced description of the 1H NMR spectra of small molecules
José G Napolitano, David C Lankin, James B McAlpine, et al.
Analytical Chemistry
|
June 3, 2024
Quantum Mechanical Quantitative Nuclear Magnetic Resonance Enables Digital Reference Standards at All Magnetic Fields and Enhances qNMR Sustainability
Yuzo Nishizaki, Naoki Sugimoto, Toru Miura, et al.
Journal of Pharmaceutical and Biomedical Analysis
|
August 27, 2024
Identification by HSQC and quantification by qHNMR innovate pharmaceutical amino acid analysis
Daniela Rebollar-Ramos, Shao-Nong Chen, David C Lankin, et al.
Journal of Chemical Information and Modeling
|
January 25, 2014
Comprehensive strategy for proton chemical shift prediction: linear prediction with nonlinear corrections
Reino Laatikainen, Tommi Hassinen, Juuso Lehtivarjo, et al.
Journal of Natural Products
|
June 5, 2014
Essential parameters for structural analysis and dereplication by (1)H NMR spectroscopy
Guido F Pauli, Shao-Nong Chen, David C Lankin, et al.
Page
of 1
Search research articles
Search
Showing results (1-10 of 10) with videos related to
Sort By:
Page
of 1
Journal of Chemical Information and Modeling
|
March 6, 2014
Universal J-coupling prediction
Juuso Lehtivarjo, Matthias Niemitz, Samuli-Petrus Korhonen
Journal of Chemical Information and Computer Sciences
|
November 25, 2003
FLUFF-BALL, a template-based grid-independent superposition and QSAR technique: validation using a benchmark steroid data set
Samuli-Petrus Korhonen, Kari Tuppurainen, Reino Laatikainen, et al.
Journal of Chemical Information and Modeling
|
November 29, 2005
Comparing the performance of FLUFF-BALL to SEAL-CoMFA with a large diverse estrogen data set: from relevant superpositions to solid predictions
Samuli-Petrus Korhonen, Kari Tuppurainen, Reino Laatikainen, et al.
Journal of Biomolecular NMR
|
October 31, 2009
4D prediction of protein (1)H chemical shifts
Juuso Lehtivarjo, Tommi Hassinen, Samuli-Petrus Korhonen, et al.
Analytical and Bioanalytical Chemistry
|
April 12, 2014
Automated quantum mechanical total line shape fitting model for quantitative NMR-based profiling of human serum metabolites
Velitchka V Mihaleva, Samuli-Petrus Korhonen, John van Duynhoven, et al.
The Journal of Organic Chemistry
|
September 7, 2013
Proton fingerprints portray molecular structures: enhanced description of the 1H NMR spectra of small molecules
José G Napolitano, David C Lankin, James B McAlpine, et al.
Analytical Chemistry
|
June 3, 2024
Quantum Mechanical Quantitative Nuclear Magnetic Resonance Enables Digital Reference Standards at All Magnetic Fields and Enhances qNMR Sustainability
Yuzo Nishizaki, Naoki Sugimoto, Toru Miura, et al.
Journal of Pharmaceutical and Biomedical Analysis
|
August 27, 2024
Identification by HSQC and quantification by qHNMR innovate pharmaceutical amino acid analysis
Daniela Rebollar-Ramos, Shao-Nong Chen, David C Lankin, et al.
Journal of Chemical Information and Modeling
|
January 25, 2014
Comprehensive strategy for proton chemical shift prediction: linear prediction with nonlinear corrections
Reino Laatikainen, Tommi Hassinen, Juuso Lehtivarjo, et al.
Journal of Natural Products
|
June 5, 2014
Essential parameters for structural analysis and dereplication by (1)H NMR spectroscopy
Guido F Pauli, Shao-Nong Chen, David C Lankin, et al.
Page
of 1