Keyword

NMR data

Description: Measurements or records produced by nuclear magnetic resonance experiments, used in chemical, biological, and metabolomic analysis.

Primary topic: Advanced NMR Techniques and Applications (64%)

OpenAlex ID: keywords/nmr-data

Using MetaboAnalyst 3.0 for Comprehensive Metabolomics Data Analysis

2016 · Jianguo Xia, David S. Wishart · Current Protocols in Bioinformatics · 1,544

The HADDOCK2.4 web server for integrative modeling of biomolecular complexes

2024 · Rodrigo V. Honorato, Mikael E. Trellet, et al. · Nature Protocols · 625

Synthesis of some 2,9‐disubstituted‐1,10‐phenanthrolines

1981 · Christopher J. Chandler, Leslie W. Deady, et al. · Journal of Heterocyclic Chemistry · 262

Molecular conformations from distance matrices

1993 · W. Glunt, T.L. Hayden, et al. · Journal of Computational Chemistry · 181

NMR‐Based Protein Potentials

2010 · Da‐Wei Li, Rafael Brüschweiler · Angewandte Chemie International Edition · 171

A Convex Model for Nonnegative Matrix Factorization and Dimensionality Reduction on Physical Space

2012 · E. Esser, M. Moller, et al. · IEEE Transactions on Image Processing · 164

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Pretreating and normalizing metabolomics data for statistical analysis

2023 · Jun Sun, Yinglin Xia · Genes & Diseases · 158

Data standards can boost metabolomics research, and if there is a will, there is a way

2015 · Philippe Rocca-Serra, Reza M. Salek, et al. · Metabolomics · 150

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Inelastic-tunneling model for the linear conductance background in the high- Tc superconductors

1990 · J. R. Kirtley, D. J. Scalapino · Physical Review Letters · 132

The VMD-XPLOR Visualization Package for NMR Structure Refinement

2001 · Charles D. Schwieters, G.Marius Clore · Journal of Magnetic Resonance · 119

Self-consistent embedded-cluster model for magnetic impurities: Fe, Co, and Ni in β′ --NiAl

1979 · D. E. Ellis, G. A. Benesh, et al. · Physical review. B, Condensed matter · 116

An Aqueous Thermodynamic Model for Polymerized Silica Species to High Ionic Strength

2001 · Andrew R. Felmy, Herman Cho, et al. · Journal of Solution Chemistry · 102

Construction of hydrodynamic bead models from high-resolution X-ray crystallographic or nuclear magnetic resonance data

1997 · O. Byron · Biophysical Journal · 94

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SWEET-DB: an attempt to create annotated data collections for carbohydrates

2002 · A. Lobeta · Nucleic Acids Research · 82

Recent advances on the Discretizable Molecular Distance Geometry Problem

2011 · Carlile Lavor, Leo Liberti, et al. · European Journal of Operational Research · 81

Multigap structure in the cuprates

1990 · V.Z. Kresin, S.A. Wolf · Physica C Superconductivity · 80

Lineshapes and artifacts in Multidimensional Fourier Transform of arbitrary sampled NMR data sets

2007 · Krzysztof Kazimierczuk, Anna Zawadzka, et al. · Journal of Magnetic Resonance · 76

Structural Analysis of Flavonoids and Related Compounds - A Review of Spectroscopic Applications

2012 · Pedro F., Gonalo C. · InTech eBooks · 66

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LAKE -- A Program System for Equilibrium Analytical Treatment of Multimethod Data, Especially Combined Potentiometric and Nuclear Magnetic Resonance Data.

1996 · Nils Ingri, Ingegärd Andersson, et al. · Acta chemica Scandinavica/Acta chemica Scandinavica. B, Organic chemistry and biochemistry/Acta chemica Scandinavica. A, Physical and inorganic chemistry/Acta chemica Scandinavica. Series B. Organic chemistry and biochemistry/Acta chemica Scandinavica. Series A, Physical and inorganic chemistry · 65

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SPECTRa: The Deposition and Validation of Primary Chemistry Research Data in Digital Repositories

2008 · Jim Downing, Peter Murray-Rust, et al. · Journal of Chemical Information and Modeling · 61

SQUID: a program for the analysis and display of data from crystallography and molecular dynamics

1992 · Thomas J. Oldfield · Journal of Molecular Graphics · 58

Molecular dynamics studies of proteins

1993 · Wilfred F. van Gunsteren · Current Opinion in Structural Biology · 53

Preparation and characterisation of palladium, platinum and manganese di(organo)carbene complexes from quinolinone and quinolinium precursorsElectronic supplementary information (ESI) available: Fig. S1: Unit cell diagram of 5. Table S1: 1H and 13C-{1H} NMR data of ligand precursors 1a and 2. See http://www.rsc.org/suppdata/dt/b3/b314217p/

2004 · Wolfgang H. Meyer, Maggel Deetlefs, et al. · Dalton Transactions · 50

99Tc NMR Spectroscopy

2005 · V. A. Mikhalev · Radiochemistry · 49

Applications of “Artificial Intelligence” for Chemical Inference, VI. Approach to a General Method of Interpreting Low Resolution Mass Spectra with a Computer

1970 · Armand Buchs, Allan B. Delfino, et al. · Helvetica Chimica Acta · 49

Works count: 9,434

Citation count: 6,059