Daresbury Laboratory

Parent institution: Science and Technology Facilities Council

ROR: 0089bg420

OpenAlex ID: I2802015276

2007 · Airlie J. McCoy, Ralf W. Grosse-Kunstleve, et al. · Journal of Applied Crystallography · 20,245

Overview of the CCP 4 suite and current developments

2011 · Martyn D. Winn, Charles C. Ballard, et al. · Acta Crystallographica Section D Biological Crystallography · 12,160

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REFMAC 5 for the refinement of macromolecular crystal structures

2011 · Garib N. Murshudov, Pavol Skubák, et al. · Acta Crystallographica Section D Biological Crystallography · 8,321

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Crystal structure of an integral membrane light-harvesting complex from photosynthetic bacteria

1995 · G. McDermott, S. M. Prince, et al. · Nature · 2,740

X-ray circular dichroism as a probe of orbital magnetization

1992 · B. T. Thole, P. Carra, et al. · Physical Review Letters · 2,723

CLUSTAL V: improved software for multiple sequence alignment

1992 · Desmond G. Higgins, Alan J. Bleasby, et al. · Computer applications in the biosciences · 2,381

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Band alignment of rutile and anatase TiO2

2013 · David O. Scanlon, Charles W. Dunnill, et al. · Nature Materials · 2,319

DL_POLY_2.0: A general-purpose parallel molecular dynamics simulation package

1996 · W. Smith, T.R. Forester · Journal of Molecular Graphics · 2,229

Use of TLS parameters to model anisotropic displacements in macromolecular refinement

2001 · M. D. Winn, M. N. Isupov, et al. · Acta Crystallographica Section D Biological Crystallography · 1,696

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Rapid identification of proteins by peptide-mass fingerprinting

1993 · D.J.C. Pappin, P. Hojrup, et al. · Current Biology · 1,615

xia2 : an expert system for macromolecular crystallography data reduction

2009 · G. Winter · Journal of Applied Crystallography · 1,413

Indication of Electron Neutrino Appearance from an Accelerator-Produced Off-Axis Muon Neutrino Beam

2011 · K. Abe, N. Abgrall, et al. · Physical Review Letters · 1,329

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Role of metal-reducing bacteria in arsenic release from Bengal delta sediments

2004 · Farhana S. Islam, Andrew G. Gault, et al. · Nature · 1,239

A graphical user interface to the CCP 4 program suite

2003 · Elizabeth Potterton, Peter Briggs, et al. · Acta Crystallographica Section D Biological Crystallography · 1,212

DL_POLY_3: new dimensions in molecular dynamics simulations via massive parallelism

2006 · Ilian T. Todorov, William Smith, et al. · Journal of Materials Chemistry · 1,151

The United Kingdom Chemical Database Service

1996 · David A. Fletcher, Robert F. McMeeking, et al. · Journal of Chemical Information and Computer Sciences · 1,102

Reliability factors for LEED calculations

1980 · J B Pendry · Journal of Physics C Solid State Physics · 1,067

QUASI: A general purpose implementation of the QM/MM approach and its application to problems in catalysis

2003 · Paul Sherwood, Alex H. de Vries, et al. · Journal of Molecular Structure THEOCHEM · 1,056

Polyisoprene-Polystyrene Diblock Copolymer Phase Diagram near the Order-Disorder Transition

1995 · Ashish K. Khandpur, Stephan Foerster, et al. · Macromolecules · 1,056

Efficient anisotropic refinement of macromolecular structures using FFT

1999 · Garib N. Murshudov, Alexei A. Vagin, et al. · Acta Crystallographica Section D Biological Crystallography · 936

On the prediction of band gaps from hybrid functional theory

2001 · J. Muscat, A. Wander, et al. · Chemical Physics Letters · 933

Mechanism of molybdenum removal from the sea and its concentration in black shales: EXAFS evidence

1996 · G.R. Helz, C.V. Miller, et al. · Geochimica et Cosmochimica Acta · 917

FCC-ee: The Lepton Collider

2019 · A. Abada, M. Abbrescia, et al. · The European Physical Journal Special Topics · 914

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Hard-X-Ray Lensless Imaging of Extended Objects

2007 · J. M. Rodenburg, A. C. Hurst, et al. · Physical Review Letters · 855

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EXAFS and the structure of glass

1985 · G.N. Greaves · Journal of Non-Crystalline Solids · 844

Works count: 10,260

Citation count: 815,000