-
1
-
-
0002638513
-
-
(Allen, F., Bergerhoff, G. & Sievers, R., eds.) Data Commission of the International Union of Crystallography, Bonn, Germany
-
Abola, E.E., Bernstein, F.C., Bryant, S.H., Koetzle, T.F. & Weng, J. (1987). Crystallographic Data Bases - Information Content, Software Systems, Scientific Applications. (Allen, F., Bergerhoff, G. & Sievers, R., eds.), pp. 107-132, Data Commission of the International Union of Crystallography, Bonn, Germany.
-
(1987)
Crystallographic Data Bases - Information Content, Software Systems, Scientific Applications
, pp. 107-132
-
-
Abola, E.E.1
Bernstein, F.C.2
Bryant, S.H.3
Koetzle, T.F.4
Weng, J.5
-
2
-
-
0000243829
-
PROCHECK: A program to check the stereochemical quality of protein structures
-
Laskowski, R.A., MacArthur, M.W., Moss, D.S. & Thornton, J.M. (1993). PROCHECK: a program to check the stereochemical quality of protein structures. J. Appl. Cryst. 26, 283-291.
-
(1993)
J. Appl. Cryst.
, vol.26
, pp. 283-291
-
-
Laskowski, R.A.1
MacArthur, M.W.2
Moss, D.S.3
Thornton, J.M.4
-
3
-
-
0025398721
-
WHATIF: A molecular modelling and drug design program
-
Vriend, G. (1990). WHATIF: a molecular modelling and drug design program J. Mol. Graph. 8, 52-56.
-
(1990)
J. Mol. Graph.
, vol.8
, pp. 52-56
-
-
Vriend, G.1
-
4
-
-
0027081912
-
SQUID: A program for the analysis and display of data from crystallography and molecular dynamics
-
Oldfield, T.J. (1992). SQUID: a program for the analysis and display of data from crystallography and molecular dynamics. J. Mol. Graph. 10, 247-252.
-
(1992)
J. Mol. Graph.
, vol.10
, pp. 247-252
-
-
Oldfield, T.J.1
-
5
-
-
0030598343
-
Deviations from standard atomic volumes as a quality measure for protein crystal structures
-
Pontius, J., Richelle, J. & Wodak, S. (1996). Deviations from standard atomic volumes as a quality measure for protein crystal structures. J. Mol. Biol. 264, 121-136.
-
(1996)
J. Mol. Biol.
, vol.264
, pp. 121-136
-
-
Pontius, J.1
Richelle, J.2
Wodak, S.3
-
6
-
-
13144266624
-
SFCHECK: A unified set of procedures for evaluating the quality of structure factor data and their agreement with the atomic model, in macromolecules
-
in press
-
Vaguine, A.J., Richelle, J. & Wodak, S. (1998). SFCHECK: a unified set of procedures for evaluating the quality of structure factor data and their agreement with the atomic model, in macromolecules. Acta Cryst. D, in press.
-
(1998)
Acta Cryst. D
-
-
Vaguine, A.J.1
Richelle, J.2
Wodak, S.3
-
7
-
-
0003477556
-
-
Edward Arnold, A Division of Hodder & Stoughton, London, UK
-
Stuart, A. & Ord, J.K. (1991). Kendall's Advanced Theory of Statistics Vol 2. Classical Inference and Relationship. 5th Edition, Edward Arnold, A Division of Hodder & Stoughton, London, UK.
-
(1991)
Kendall's Advanced Theory of Statistics Vol 2. Classical Inference and Relationship. 5th Edition
, vol.2
-
-
Stuart, A.1
Ord, J.K.2
-
8
-
-
0002081741
-
-
(Rollett, J.S., ed) Pergamon Press, Oxford, UK
-
Cruickshank, D. (1965). Computing Methods in Crystallography. (Rollett, J.S., ed), pp. 112-116, Pergamon Press, Oxford, UK.
-
(1965)
Computing Methods in Crystallography
, pp. 112-116
-
-
Cruickshank, D.1
-
9
-
-
0030880598
-
SHELXL: High resolution refinement
-
Carter, C.W. & Sweet, R.M. eds
-
Sheldrick, G.M. & Schneider, T.R. (1997). SHELXL: high resolution refinement. (Carter, C.W. & Sweet, R.M. eds), Methods Enzymol. 277, 319-343.
-
(1997)
Methods Enzymol.
, vol.277
, pp. 319-343
-
-
Sheldrick, G.M.1
Schneider, T.R.2
-
10
-
-
0029646113
-
The crystal structure of the oligo-peptide binding protein Oppa complexed with tripeptide and tetrapeptide ligands
-
Tame, J.R.H., Dodson, E.J., Murshudov, G.N., Higgins, C.F. & Wilkinson, A.J. (1995). The crystal structure of the oligo-peptide binding protein Oppa complexed with tripeptide and tetrapeptide ligands. Structure 3, 1395-1406.
-
(1995)
Structure
, vol.3
, pp. 1395-1406
-
-
Tame, J.R.H.1
Dodson, E.J.2
Murshudov, G.N.3
Higgins, C.F.4
Wilkinson, A.J.5
-
11
-
-
0039299578
-
Who checks the checkers ? Four validation tools applied to eight atomic resolution structures
-
EU 3-D Validation Network: Wilson, K.S., et al., & Rullmann, J.A.C. (1998). Who checks the checkers ? Four validation tools applied to eight atomic resolution structures. J. Mol. Biol. 276, 417-436.
-
(1998)
J. Mol. Biol.
, vol.276
, pp. 417-436
-
-
Wilson, K.S.1
Rullmann, J.A.C.2
-
12
-
-
0030497978
-
Efficient rebuilding of protein structure
-
Kleywegt, G.J. & Jones, T.A. (1996). Efficient rebuilding of protein structure. Acta Cryst. D 52, 829-832.
-
(1996)
Acta Cryst. D
, vol.52
, pp. 829-832
-
-
Kleywegt, G.J.1
Jones, T.A.2
-
13
-
-
33044489780
-
A semi-automated map fitting procedure
-
(Bourne, P.E. & Watenpaugh, K. eds), Western Washington University, WA
-
Oldfield, T. (1996) A semi-automated map fitting procedure. In Crystallographic Computing 7. Proceedings from the Macromolecular Crystallographic Computing School (17-22 August 1996). (Bourne, P.E. & Watenpaugh, K. eds), Western Washington University, WA.
-
(1996)
Crystallographic Computing 7. Proceedings from the Macromolecular Crystallographic Computing School (17-22 August 1996)
-
-
Oldfield, T.1
-
14
-
-
0001635093
-
The Cambridge Crystallographic Data Centre: Computer-based search, retrieval, analysis and display of information
-
Allen, F.H.S., et al., & Watson, D.G. (1979). The Cambridge Crystallographic Data Centre: computer-based search, retrieval, analysis and display of information. Acta Cryst. B 35, 2331-2339.
-
(1979)
Acta Cryst. B
, vol.35
, pp. 2331-2339
-
-
Allen, F.H.S.1
Watson, D.G.2
-
15
-
-
79952608525
-
Accurate bond and angle parameters for X-ray protein structure refinement
-
Engh, R.A. & Huber, R. (1991). Accurate bond and angle parameters for X-ray protein structure refinement. Acta Cryst. A 47, 392-400.
-
(1991)
Acta Cryst. A
, vol.47
, pp. 392-400
-
-
Engh, R.A.1
Huber, R.2
-
17
-
-
0002860357
-
Incorporation of stereochemical information into crystallographic refinement
-
(Diamond, R., Ramasechan, S. & Venkatesan, K. eds) Indian Institute of Science, Bangalore, India
-
Hendrickson, W.A. & Konnert, J.H. (1980). Incorporation of stereochemical information into crystallographic refinement. In Computing in Crystallography. (Diamond, R., Ramasechan, S. & Venkatesan, K. eds), pp. 13.01-13.25, Indian Institute of Science, Bangalore, India.
-
(1980)
Computing in Crystallography
-
-
Hendrickson, W.A.1
Konnert, J.H.2
-
19
-
-
0013580834
-
Maximum-likelihood structure refinement: Theory and implementation within Buster and TNT
-
(Dodson, E., Moore, M., Ralph A. & Bailey, S., eds) SERC Daresbury Laboratory, Warrington, UK
-
Bricogne, G. & Irwin, J. (1996). Maximum-likelihood structure refinement: theory and implementation within Buster and TNT. In Macromolecular Refinement: Proceedings of the CCP4 Study Weekend, January 1996. (Dodson, E., Moore, M., Ralph A. & Bailey, S., eds), pp. 85-92, SERC Daresbury Laboratory, Warrington, UK.
-
(1996)
Macromolecular Refinement: Proceedings of the CCP4 Study Weekend, January 1996
, pp. 85-92
-
-
Bricogne, G.1
Irwin, J.2
-
20
-
-
85030337270
-
Improved structure refinement through maximum-likelihood
-
(Dodson, E., Moore, M., Ralph, A. & Bailey, S., eds) SERC Daresbury Laboratory, Warrington, UK
-
Pannu, N.S. & Read, R.J. (1996). Improved structure refinement through maximum-likelihood. In Macromolecular Refinement: Proceedings of the CCP4 Study Weekend, January 1996. (Dodson, E., Moore, M., Ralph, A. & Bailey, S., eds), pp. 75-84, SERC Daresbury Laboratory, Warrington, UK.
-
(1996)
Macromolecular Refinement: Proceedings of the CCP4 Study Weekend, January 1996
, pp. 75-84
-
-
Pannu, N.S.1
Read, R.J.2
-
21
-
-
0030924992
-
Refinement of macromolecular structures by the maximum likelihood method
-
Murshudov, G.N., Vagin, A.A. & Dodson, E.J. (1997). Refinement of macromolecular structures by the maximum likelihood method. Acta Cryst. D 53, 240-255.
-
(1997)
Acta Cryst. D
, vol.53
, pp. 240-255
-
-
Murshudov, G.N.1
Vagin, A.A.2
Dodson, E.J.3
-
22
-
-
0026597444
-
Free R-value - A novel statistical quantity for assessing the accuracy of crystal structures
-
Brünger, AT. (1992). Free R-value - a novel statistical quantity for assessing the accuracy of crystal structures. Nature 355, 472-475.
-
(1992)
Nature
, vol.355
, pp. 472-475
-
-
Brünger, A.T.1
-
23
-
-
0001099937
-
Traitement statistique des erreurs dans la determination des structures cristallines
-
Luzzati, V. (1952). Traitement statistique des erreurs dans la determination des structures cristallines. Acta Cryst. 5, 802-810.
-
(1952)
Acta Cryst.
, vol.5
, pp. 802-810
-
-
Luzzati, V.1
-
24
-
-
13144283580
-
-
PhD thesis, University of York, York, UK
-
Butterworth, S. (1996). Single crystal X-ray diffraction studies for small, medium and large molecules. PhD thesis, University of York, York, UK.
-
(1996)
Single Crystal X-ray Diffraction Studies for Small, Medium and Large Molecules
-
-
Butterworth, S.1
-
25
-
-
84889120137
-
Improving methods for building protein models in electron density maps and the location of errors in these models
-
Jones, T.A., Zou, J.Y. Cowan, S.W. & Kjeldgaard, M. (1991). Improving methods for building protein models in electron density maps and the location of errors in these models. Acta Cryst. A 47, 110-119.
-
(1991)
Acta Cryst. A
, vol.47
, pp. 110-119
-
-
Jones, T.A.1
Zou, J.Y.2
Cowan, S.W.3
Kjeldgaard, M.4
-
26
-
-
85030334984
-
-
Quanta, Molecular Simulations Inc. (1997). 9685 Scranton Rd, San Diego, CA 92121-3752, USA
-
Quanta, Molecular Simulations Inc. (1997). 9685 Scranton Rd, San Diego, CA 92121-3752, USA.
-
-
-
-
28
-
-
0028070557
-
Torsion angle dynamics - Reduced variable conformation sampling enhances crystallographic refinement
-
Rice, L.M. & Brünger, A.T. (1994). Torsion angle dynamics - reduced variable conformation sampling enhances crystallographic refinement. Proteins 19, 277-290.
-
(1994)
Proteins
, vol.19
, pp. 277-290
-
-
Rice, L.M.1
Brünger, A.T.2
-
29
-
-
73649194755
-
Stereochemistry of polypeptide chain configurations
-
Ramachandran, G.N., Ramakrishnan, C. & Sasisekharan, V. (1963). Stereochemistry of polypeptide chain configurations. J. Mol. Biol. 7, 95-99.
-
(1963)
J. Mol. Biol.
, vol.7
, pp. 95-99
-
-
Ramachandran, G.N.1
Ramakrishnan, C.2
Sasisekharan, V.3
-
30
-
-
0002663405
-
Protein precision re-examined: Luzzati plots do not estimate final errors
-
(Dodson, E., Moore, M., Ralph, A. & Bailey, S., eds) SERC Daresbury Laboratory, Warrington, UK
-
Cruickshank, D. (1996). Protein precision re-examined: Luzzati plots do not estimate final errors. In Proceedings of the CCP4 Study Weekend, 4-5 January 1996. (Dodson, E., Moore, M., Ralph, A. & Bailey, S., eds), pp. 11-22, SERC Daresbury Laboratory, Warrington, UK.
-
(1996)
Proceedings of the CCP4 Study Weekend, 4-5 January 1996
, pp. 11-22
-
-
Cruickshank, D.1
-
31
-
-
0032031476
-
Error estimates of protein structure coordinates and deviations from standard geometry by full-matrix refinement of γB- and βB2-crystallin
-
Tickle, I.J., Laskowski, R.A. & Moss, D.A. (1998). Error estimates of protein structure coordinates and deviations from standard geometry by full-matrix refinement of γB- and βB2-crystallin. Acta Cryst. D 54, 243-252.
-
(1998)
Acta Cryst. D
, vol.54
, pp. 243-252
-
-
Tickle, I.J.1
Laskowski, R.A.2
Moss, D.A.3
-
32
-
-
85038202596
-
Full matrix least squares
-
(Dodson, E., Moore, M., Ralph, A. & Bailey, S., eds) SERC Daresbury Laboratory, Warrington, UK
-
Ten Eyck, L.F. (1996). Full matrix least squares. In Macromolecular Refinement: Proceedings of the CCP4 Study Weekend, January 1996. (Dodson, E., Moore, M., Ralph, A. & Bailey, S., eds), pp. 37-46, SERC Daresbury Laboratory, Warrington, UK.
-
(1996)
Macromolecular Refinement: Proceedings of the CCP4 Study Weekend, January 1996
, pp. 37-46
-
-
Ten Eyck, L.F.1
|