Most cited papers in Advanced NMR Techniques and Applications
What are the most cited papers in Advanced NMR Techniques and Applications?
The most cited paper in Advanced NMR Techniques and Applications is "General atomic and molecular electronic structure system" (Michael W. I. Schmidt, Kim K. Baldridge, Jerry A. Boatz et al., 1993), with 20,303 citations. Next come "Crystallography & NMR System: A New Software Suite for Macromolecular Structure Determination" (15,809) and "The SIESTA method for ab initio order- N materials simulation" (11,955).
Showing 50 of 100 papers. Every paper with more than 1,522 citations is listed.
| # | Paper | ||
|---|---|---|---|
| 1 | General atomic and molecular electronic structure system Michael W. I. Schmidt, Kim K. Baldridge, Jerry A. Boatz et al. · Journal of Computational Chemistry | Nov 1993 | 20,303 |
| 2 | Crystallography & NMR System: A New Software Suite for Macromolecular Structure Determination Axel T. Brünger, Paul D. Adams, G. Marius Clore et al. · Acta Crystallographica Section D Biological Crystallography | Sep 1998 | 15,809 |
| 3 | The SIESTA method for ab initio order- N materials simulation José M. Soler, Emilio Artacho, Julian D. Gale et al. · Journal of Physics Condensed Matter | 8 Mar 2002 | 11,955 |
| 4 | Chemistry with ADF G. te Velde, F. Matthias Bickelhaupt, Evert Jan Baerends et al. · Journal of Computational Chemistry | 23 Apr 2001 | 10,169 |
| 5 | P ACKMOL : A package for building initial configurations for molecular dynamics simulations Leandro Martı́nez, Ricardo Andrade, Ernesto G. Birgin et al. · Journal of Computational Chemistry | 19 Feb 2009 | 9,884 |
| 6 | Spin Diffusion Measurements: Spin Echoes in the Presence of a Time-Dependent Field Gradient Edward O. Stejskal, J. E. Tanner · The Journal of Chemical Physics | 1965 | 8,342 |
| 7 | NMR with Proteins and Nucleic Acids Kurt Wüthrich · Europhysics news | 1986 | 8,011 |
| 8 | Climbing the Density Functional Ladder: Nonempirical Meta–Generalized Gradient Approximation Designed for Molecules and Solids Jianmin Tao, John P. Perdew, Viktor N. Staroverov et al. · Physical Review Letters | 30 Sep 2003 | 7,211 |
| 9 | EasySpin, a comprehensive software package for spectral simulation and analysis in EPR Stefan W. Stoll, Arthur Schweiger · Journal of Magnetic Resonance | 27 Sep 2005 | 6,580 |
| 10 | N4ITK: Improved N3 Bias Correction Nicholas J. Tustison, Brian Avants, Philip A. Cook et al. · IEEE Transactions on Medical Imaging | 9 Apr 2010 | 6,579 |
| 11 | Effects of Diffusion on Free Precession in Nuclear Magnetic Resonance Experiments Herman Y. Carr, Edward M. Purcell · Physical Review | May 1954 | 6,504 |
| 12 | Improved side‐chain torsion potentials for the Amber ff99SB protein force field Kresten Lindorff‐Larsen, Stefano Piana, Kim Palmö et al. · Proteins Structure Function and Bioinformatics | 10 Mar 2010 | 6,478 |
| 13 | SENSE: Sensitivity encoding for fast MRI Klaas P. Pruessmann, Markus Weiger, Markus Beat Scheidegger et al. · Magnetic Resonance in Medicine | Nov 1999 | 6,198 |
| 14 | Modified Spin-Echo Method for Measuring Nuclear Relaxation Times Saul Meiboom, Deepak S. Gill · Review of Scientific Instruments | Aug 1958 | 6,070 |
| 15 | The ORCA quantum chemistry program package Frank Neese, Frank Wennmohs, Ute Becker et al. · The Journal of Chemical Physics | 12 Jun 2020 | 5,351 |
| 16 | Spin Echoes Erwin Louis Hahn · Physical Review | 15 Nov 1950 | 5,051 |
| 17 | Hydrogen Storage in Microporous Metal-Organic Frameworks Nathaniel L. Rosi, Juergen Eckert, Mohamed Eddaoudi et al. · Science | 15 May 2003 | 4,858 |
| 18 | Investigation of exchange processes by two-dimensional NMR spectroscopy J. Jeener, Beat H. Meier, Paul Bachmann et al. · The Journal of Chemical Physics | Dec 1979 | 4,770 |
| 19 | CHARMM36 all-atom additive protein force field: Validation based on comparison to NMR data Jing Huang, Alexander D. MacKerell · Journal of Computational Chemistry | 6 Jul 2013 | 4,763 |
| 20 | Hydrogen storage in metal–organic frameworks Leslie J. Murray, Mircea Dincă, Jeffrey R. Long · Chemical Society Reviews | 2009 | 4,540 |
| 21 | Gadolinium(III) Chelates as MRI Contrast Agents: Structure, Dynamics, and Applications Peter D. Caravan, Jeffrey J. Ellison, Thomas J. McMurry et al. · Chemical Reviews | 20 Aug 1999 | 4,494 |
| 22 | Modelling one‐ and two‐dimensional solid‐state NMR spectra Dominique Massiot, Franck Fayon, Mickaël Capron et al. · Magnetic Resonance in Chemistry | 10 Dec 2001 | 4,266 |
| 23 | Principles of Nuclear Magnetic Resonance in One and Two Dimensions Richard R. Ernst, Geoffrey Bodenhausen, Alexander Wokaun et al. · Physics Today | Jul 1989 | 4,236 |
| 24 | PLUMED 2: New feathers for an old bird Gareth A. Tribello, Massimiliano Bonomi, Davide Branduardi et al. · Computer Physics Communications | 29 Sep 2013 | 3,834 |
| 25 | Indirect Exchange Coupling of Nuclear Magnetic Moments by Conduction Electrons Malvin A. Ruderman, CHARLES KITTEL · Physical Review | Oct 1954 | 3,834 |
| 26 | Gradient-tailored excitation for single-quantum NMR spectroscopy of aqueous solutions Martial Piotto, Vladimı́r Saudek, Vladimı́r Sklenář · Journal of Biomolecular NMR | Nov 1992 | 3,730 |
| 27 | MLEV-17-based two-dimensional homonuclear magnetization transfer spectroscopy Ad Bax, Donald G. Davis · Journal of Magnetic Resonance (1969) | Nov 1985 | 3,621 |
| 28 | Scalable molecular dynamics on CPU and GPU architectures with NAMD James Christopher Phillips et al. · The Journal of Chemical Physics | 28 Jul 2020 | 3,391 |
| 29 | A PCAC puzzle: π0→γγ in the σ-model James S. Bell, R. Jackiw · Nuovo cimento della Società italiana di fisica. A, Nuclei, particles and fields | Mar 1969 | 3,284 |
| 30 | Relaxation Processes in a System of Two Spins Ionel Solomon · Physical Review | 15 Jul 1955 | 3,278 |
| 31 | Application of phase sensitive two-dimensional correlated spectroscopy (COSY) for measurements of 1H-1H spin-spin coupling constants in proteins Dominique P. Marion, Kurt Wüthrich · Biochemical and Biophysical Research Communications | Jun 1983 | 3,160 |
| 32 | Two-dimensional spectroscopy. Application to nuclear magnetic resonance W.P Aue, E. Bartholdi, Richard R. Ernst · The Journal of Chemical Physics | Mar 1976 | 3,074 |
| 33 | Quantum computing in molecular magnets Michael Niklaus Leuenberger, Daniel Loss · Nature | Apr 2001 | 3,010 |
| 34 | Increase in signal-to-noise ratio of > 10,000 times in liquid-state NMR Jan Henrik Ardenkjær‐Larsen, Björn Fridlund, Andreas Gram et al. · Proceedings of the National Academy of Sciences | 20 Aug 2003 | 2,876 |
| 35 | OpenMM 7: Rapid development of high performance algorithms for molecular dynamics Peter K. Eastman, Jason Swails, John D. Chodera et al. · PLoS Computational Biology | 26 Jul 2017 | 2,869 |
| 36 | Torsion angle dynamics for NMR structure calculation with the new program Dyana Peter Güntert, Ch. Mumenthaler, Kurt Wüthrich · Journal of Molecular Biology | Oct 1997 | 2,817 |
| 37 | MP2 energy evaluation by direct methods Martin Head‐Gordon, John Anthony Pople, Michael J. Frisch · Chemical Physics Letters | Dec 1988 | 2,804 |
| 38 | Coherence transfer by isotropic mixing: Application to proton correlation spectroscopy L Braunschweiler, Richard R. Ernst · Journal of Magnetic Resonance (1969) | Jul 1983 | 2,656 |
| 39 | Local phenomenological nucleon-nucleon potentials Roderick V. Reid · Annals of Physics | Dec 1968 | 2,597 |
| 40 | A two-dimensional nuclear overhauser experiment with pure absorption phase in four quadrants David J. States, Ronald A. Haberkorn, David J. Ruben · Journal of Magnetic Resonance (1969) | Jun 1982 | 2,584 |
| 41 | TALOS+: a hybrid method for predicting protein backbone torsion angles from NMR chemical shifts Yang Shen, Frank Delaglio, Gabriel Cornilescu et al. · Journal of Biomolecular NMR | 22 Jun 2009 | 2,583 |
| 42 | Natural abundance nitrogen-15 NMR by enhanced heteronuclear spectroscopy Geoffrey Bodenhausen, David J. Ruben · Chemical Physics Letters | 1980 | 2,573 |
| 43 | Self-consistent mean-field models for nuclear structure M. Bender, P.-H. Heenen, P.‐G. Reinhard · Reviews of Modern Physics | 23 Jan 2003 | 2,522 |
| 44 | The axial vector current in beta decay Murray Gell‐Mann, Maurice M. Lévy · Il Nuovo Cimento | May 1960 | 2,503 |
| 45 | Proton-enhanced NMR of dilute spins in solids Alexander Pines, M. G. Gibby, John S. Waugh · The Journal of Chemical Physics | 15 Jul 1973 | 2,498 |
| 46 | [16] SHELXL: High-resolution refinement George M. Sheldrick, Thomas R. Schneider · Methods in enzymology on CD-ROM/Methods in enzymology | 1997 | 2,491 |
| 47 | Attenuated T 2 relaxation by mutual cancellation of dipole–dipole coupling and chemical shift anisotropy indicates an avenue to NMR structures of very large biological macromolecules in solution Konstantin Pervushin, Roland Riek, Gerhard Wider et al. · Proceedings of the National Academy of Sciences | 11 Nov 1997 | 2,471 |
| 48 | Improved spectral resolution in COSY 1H NMR spectra of proteins via double quantum filtering Mark Rance, Ole W. Sørensen, Geoffrey Bodenhausen et al. · Biochemical and Biophysical Research Communications | Dec 1983 | 2,321 |
| 49 | Anomalous paramagnetism of copper acetate BREBIS BLEANEY, K D Bowers · Proceedings of the Royal Society of London A Mathematical and Physical Sciences | 9 Oct 1952 | 2,303 |
| 50 | Oxygenation‐sensitive contrast in magnetic resonance image of rodent brain at high magnetic fields Seiji Ogawa, Tso‐Ming Lee, Asha S. Nayak et al. · Magnetic Resonance in Medicine | Apr 1990 | 2,288 |
Citations are OpenAlex's own counts, from its 2026-09-23 snapshot, so the ranking can differ from Google Scholar or Web of Science. A paper is listed for a field when OpenAlex files it under one of the field's topics; retracted papers and papers whose citation count cannot be traced to citing works are left out, and a preprint and the article it became are shown once. Release dates are OpenAlex's: where a source gave only a month or a year, that is what is shown. How the lists are chosen.