-
1
-
-
0004106191
-
-
Essentials of Glycobiology, 2nd ed. Press: Cold Spring Harbor, NY
-
Essentials of Glycobiology, 2nd ed.; Varki, A., Cummings, R. D., Esko, J. D., Freeze, H. H., Stanley, P., Bertozzi, C. R., Hart, G. W., Etzler, M. E., Eds; Cold Spring Harbor Laboratory Press: Cold Spring Harbor, NY, 2009.
-
(2009)
Cold Spring Harbor Laboratory
-
-
Varki, A.1
Cummings, R.D.2
Esko, J.D.3
Freeze, H.H.4
Stanley, P.5
Bertozzi, C.R.6
Hart, G.W.7
Etzler, M.E.8
-
2
-
-
0032985340
-
Structure and conformation of complex carbohydrates of glycoproteins, glycolipids, and bacterial polysaccharides
-
Bush, C. A.; Martin-Pastor, M.; Imberty, A. Structure and Conformation of Complex Carbohydrates of Glycoproteins, Glycolipids, and Bacterial Polysaccharides. Annu. Rev. Biophys. Biomol. Struct. 1999, 28, 269-293.
-
(1999)
Annu. Rev. Biophys. Biomol. Struct.
, vol.28
, pp. 269-293
-
-
Bush, C.A.1
Martin-Pastor, M.2
Imberty, A.3
-
3
-
-
72649089798
-
Glycan flexibility: Insights into nanosecond dynamics from a microsecond molecular dynamics simulation explaining an unusual nuclear overhauser effect
-
Landstrom, J.; Widmalm, G. Glycan Flexibility: Insights into Nanosecond Dynamics from a Microsecond Molecular Dynamics Simulation Explaining an Unusual Nuclear Overhauser Effect. Carbohydr. Res. 2010, 345, 330-333.
-
(2010)
Carbohydr. Res.
, vol.345
, pp. 330-333
-
-
Landstrom, J.1
Widmalm, G.2
-
4
-
-
84859364051
-
Assigning kinetic 3d-signatures to glycocodes
-
Sattelle, B. M.; Almond, A. Assigning Kinetic 3D-Signatures to Glycocodes. Phys. Chem. Chem. Phys. 2012, 14, 5843-5848.
-
(2012)
Phys. Chem. Chem. Phys.
, vol.14
, pp. 5843-5848
-
-
Sattelle, B.M.1
Almond, A.2
-
5
-
-
78751674922
-
Conformational properties of methyl β-maltoside and methyl α-and β-cellobioside disaccharides
-
Hatcher, E.; Sawen, E.; Widmalm, G.; MacKerell, A. D., Jr. Conformational Properties of Methyl β-Maltoside and Methyl α-and β-Cellobioside Disaccharides. J. Phys. Chem. B 2011, 115, 597-608.
-
(2011)
J. Phys. Chem. B
, vol.115
, pp. 597-608
-
-
Hatcher, E.1
Sawen, E.2
Widmalm, G.3
MacKerell Jr., A.D.4
-
6
-
-
84959938537
-
A conformational study of hydroxymethyl groups in carbohydrates investigated by 1h nmr spectroscopy
-
Bock, K.; Duus, J. Ø. A Conformational Study of Hydroxymethyl Groups in Carbohydrates Investigated by 1H NMR Spectroscopy. J. Carbohydr. Chem. 1994, 13, 513-543.
-
(1994)
J. Carbohydr. Chem.
, vol.13
, pp. 513-543
-
-
Bock, K.1
Duus, J.2
-
7
-
-
0037039955
-
Hydroxymethyl group conformation in saccharides: Structural dependencies of 2jhh, 3jhh, and 1jch spin-spin coupling constants
-
Stenutz, R.; Carmichael, I.; Widmalm, G.; Serianni, A. S. Hydroxymethyl Group Conformation in Saccharides: Structural Dependencies of 2JHH, 3JHH, and 1JCH Spin-Spin Coupling Constants. J. Org. Chem. 2002, 67, 949-958.
-
(2002)
J. Org. Chem.
, vol.67
, pp. 949-958
-
-
Stenutz, R.1
Carmichael, I.2
Widmalm, G.3
Serianni, A.S.4
-
8
-
-
33746024043
-
Reconciling solvent effects on rotamer populations in carbohydrates -a joint md and nmr analysis
-
Gonzalez-Outeirino, J.; Kirschner, K. N.; Thobhani, S.; Woods, R. J. Reconciling Solvent Effects on Rotamer Populations in Carbohydrates -A Joint MD and NMR Analysis. Can. J. Chem. 2006, 84, 569-579.
-
(2006)
Can. J. Chem.
, vol.84
, pp. 569-579
-
-
Gonzalez-Outeirino, J.1
Kirschner, K.N.2
Thobhani, S.3
Woods, R.J.4
-
9
-
-
57949100084
-
Stereoelectronic and solvation effects determine hydroxymethyl conformational preferences in monosaccharides
-
Barnett, C. B.; Naidoo, K. J. Stereoelectronic and Solvation Effects Determine Hydroxymethyl Conformational Preferences in Monosaccharides. J. Phys. Chem. B 2008, 112, 15450-15459.
-
(2008)
J. Phys. Chem. B
, vol.112
, pp. 15450-15459
-
-
Barnett, C.B.1
Naidoo, K.J.2
-
10
-
-
33947091734
-
Gauche effect. Stereochemical consequences of adjacent electron pairs and polar bonds
-
Wolfe, S. Gauche Effect. Stereochemical Consequences of Adjacent Electron Pairs and Polar Bonds. Acc. Chem. Res. 1972, 5, 102-111.
-
(1972)
Acc. Chem. Res.
, vol.5
, pp. 102-111
-
-
Wolfe, S.1
-
11
-
-
34548262693
-
Is there a general rule for the gauche effect in the conformational isomerism of 1,2-disubstituted ethanes
-
Freitas, M. P.; Rittner, R. Is There a General Rule for the Gauche Effect in the Conformational Isomerism of 1,2-Disubstituted Ethanes? J. Phys. Chem. A 2007, 111, 7233-7236.
-
(2007)
J. Phys. Chem. A
, vol.111
, pp. 7233-7236
-
-
Freitas, M.P.1
Rittner, R.2
-
12
-
-
0001327831
-
The structure of molecules containing cyclohexane or pyranose rings
-
Hassel, O.; Ottar, B. The Structure of Molecules Containing Cyclohexane or Pyranose Rings. Acta Chem. Scand. 1947, 1, 929-943.
-
(1947)
Acta Chem. Scand.
, vol.1
, pp. 929-943
-
-
Hassel, O.1
Ottar, B.2
-
13
-
-
0026848772
-
Analysis of conformationally restricted models for the (1→6)-branch of asparagine-linked oligosaccharides by N.M.R.-spectroscopy and hsea calculation
-
Bock, K.; Duus, J. Ø.; Hindsgaul, O.; Lindh, I. Analysis of Conformationally Restricted Models for the (1→6)-Branch of Asparagine-Linked Oligosaccharides by n.m.r.-Spectroscopy and HSEA Calculation. Carbohydr. Res. 1992, 228, 1-20.
-
(1992)
Carbohydr. Res.
, vol.228
, pp. 1-20
-
-
Bock, K.1
Duus, J.2
Hindsgaul, O.3
Lindh, I.4
-
14
-
-
3242888034
-
Nmr and molecular modeling studies of the interaction between wheat germ agglutinin and the β-d-glcpnac-(1→6)-α-d-manp epitope present in glycoproteins of tumor cells
-
Lycknert, K.; Edblad, M.; Imberty, A.; Widmalm, G. NMR and Molecular Modeling Studies of the Interaction Between Wheat Germ Agglutinin and the β-D-GlcpNAc-(1→6)-α-D-Manp Epitope Present in Glycoproteins of Tumor Cells. Biochemistry 2004, 43, 9647-9654.
-
(2004)
Biochemistry
, vol.43
, pp. 9647-9654
-
-
Lycknert, K.1
Edblad, M.2
Imberty, A.3
Widmalm, G.4
-
15
-
-
1542285296
-
A hydration study of (1→4) and (1→6) linked α-glucans by comparative 10 ns molecular dynamics simulations and 500-mhz nmr
-
Corzana, F.; Motawia, M. S.; Herve du Penhoat, C.; Perez, S.; Tschampel, S. M.; Woods, R. J.; Engelsen, S. B. A Hydration Study of (1→4) and (1→6) Linked α-Glucans by Comparative 10 ns Molecular Dynamics Simulations and 500-MHz NMR. J. Comput. Chem. 2004, 25, 573-586.
-
(2004)
J. Comput. Chem.
, vol.25
, pp. 573-586
-
-
Corzana, F.1
Motawia, M.S.2
Herve Du Penhoat, C.3
Perez, S.4
Tschampel, S.M.5
Woods, R.J.6
Engelsen, S.B.7
-
16
-
-
46449115657
-
Conformational analysis of β-glycosidic linkages in 13c-labeled glucobiosides using inter-residue scalar coupling constants
-
Olsson, U.; Serianni, A. S.; Stenutz, R. Conformational Analysis of β-Glycosidic Linkages in 13C-Labeled Glucobiosides Using Inter-Residue Scalar Coupling Constants. J. Phys. Chem. B 2008, 112, 4447-4453.
-
(2008)
J. Phys. Chem. B
, vol.112
, pp. 4447-4453
-
-
Olsson, U.1
Serianni, A.S.2
Stenutz, R.3
-
17
-
-
69749105434
-
Conformational flexibility and dynamics of two (1→6)-linked disaccharides related to an oligosaccharide epitope expressed on malignant tumour cells
-
Olsson, U.; Sawen, E.; Stenutz, R.; Widmalm, G. Conformational Flexibility and Dynamics of Two (1→6)-Linked Disaccharides Related to an Oligosaccharide Epitope Expressed on Malignant Tumour Cells. Chem. Eur. J. 2009, 15, 8886-8894.
-
(2009)
Chem. Eur. J.
, vol.15
, pp. 8886-8894
-
-
Olsson, U.1
Sawen, E.2
Stenutz, R.3
Widmalm, G.4
-
18
-
-
77955659423
-
Conformational properties of glucose-based disaccharides investigated using molecular dynamics simulations with local elevation umbrella sampling
-
Peric-Hassler, L.; Hansen, H. S.; Baron, R.; Hunenberger, P. H. Conformational Properties of Glucose-Based Disaccharides Investigated Using Molecular Dynamics Simulations with Local Elevation Umbrella Sampling. Carbohydr. Res. 2010, 345, 1781-1801.
-
(2010)
Carbohydr. Res.
, vol.345
, pp. 1781-1801
-
-
Peric-Hassler, L.1
Hansen, H.S.2
Baron, R.3
Hunenberger, P.H.4
-
19
-
-
0028434208
-
Relaxed-residue conformational mapping of the three linkage bonds of isomaltose and gentiobiose with mm3 (92
-
Dowd, M. K.; Reilly, P. J.; French, A. D. Relaxed-Residue Conformational Mapping of the Three Linkage Bonds of Isomaltose and Gentiobiose with MM3(92). Biopolymers 1994, 34, 625-638.
-
(1994)
Biopolymers
, vol.34
, pp. 625-638
-
-
Dowd, M.K.1
Reilly, P.J.2
French, A.D.3
-
20
-
-
33744818146
-
Conformational and dynamical properties of disaccharides in water: A molecular dynamics study
-
Pereira, C. S.; Kony, D.; Baron, R.; Muller, M.; van Gunsteren, W. F.; Hunenberger, P. H. Conformational and Dynamical Properties of Disaccharides in Water: A Molecular Dynamics Study. Biophys. J. 2006, 90, 4337-4344.
-
(2006)
Biophys. J.
, vol.90
, pp. 4337-4344
-
-
Pereira, C.S.1
Kony, D.2
Baron, R.3
Muller, M.4
Van Gunsteren, W.F.5
Hunenberger, P.H.6
-
21
-
-
73449099648
-
An integrated approach to nmr spin relaxation in flexible biomolecules: Application to β-d-glucopyranosyl-(1→6)-α-d-mannopyranosyl-ome
-
Zerbetto, M.; Polimeno, A.; Kotsyubynskyy, D.; Ghalebani, L.; Kowalewski, J.; Meirovitch, E.; Olsson, U.; Widmalm, G. An Integrated Approach to NMR Spin Relaxation in Flexible Biomolecules: Application to β-D-Glucopyranosyl- (1→6)-α-D-Mannopyranosyl-OMe. J. Chem. Phys. 2009, 131, 234501.
-
(2009)
J Chem. Phys.
, vol.131
, pp. 234501
-
-
Zerbetto, M.1
Polimeno, A.2
Kotsyubynskyy, D.3
Ghalebani, L.4
Kowalewski, J.5
Meirovitch, E.6
Olsson, U.7
Widmalm, G.8
-
22
-
-
84866517798
-
Structural analyses of mannose pentasaccharide of high mannose type oligosaccharides by 1d and 2d nmr spectroscopy
-
Kubota, Y.; Hori, H.; Sawa, R.; Seki, H.; Uzawa, J. Structural Analyses of Mannose Pentasaccharide of High Mannose Type Oligosaccharides by 1D and 2D NMR Spectroscopy. Magn. Reson. Chem. 2012, 50, 659-664.
-
(2012)
Magn. Reson. Chem.
, vol.50
, pp. 659-664
-
-
Kubota, Y.1
Hori, H.2
Sawa, R.3
Seki, H.4
Uzawa, J.5
-
23
-
-
3343018656
-
Chemical biology of the sugar code
-
Gabius, H.-J.; Siebert, H.-C.; Andre, S.; Jimenez-Barbero, J.; Rudiger, H. Chemical Biology of the Sugar Code. ChemBioChem 2004, 5, 740-764.
-
(2004)
Chem Bio Chem
, vol.5
, pp. 740-764
-
-
Gabius, H.-J.1
Siebert, H.-C.2
Andre, S.3
Jimenez-Barbero, J.4
Rudiger, H.5
-
24
-
-
37049090382
-
Synthesis and nuclear magnetic resonance studies of some l-fucosyl-containing disaccharides
-
Baumann, H.; Jansson, P.-E.; Kenne, L. Synthesis and Nuclear Magnetic Resonance Studies of Some L-Fucosyl-Containing Disaccharides. J. Chem. Soc., Perkin Trans. 1 1991, 2229-2233.
-
(1991)
Perkin Trans. J. Chem. Soc.
, vol.1
, pp. 2229-2233
-
-
Baumann, H.1
Jansson, P.-E.2
Kenne, L.3
-
26
-
-
33747874895
-
Revisiting the initial rate approximation in kinetic noe measurements
-
Hu, H.; Krishnamurthy, K. Revisiting the Initial Rate Approximation in Kinetic NOE Measurements. J. Magn. Reson. 2006, 182, 173-177.
-
(2006)
J. Magn. Reson.
, vol.182
, pp. 173-177
-
-
Hu, H.1
Krishnamurthy, K.2
-
28
-
-
0001582736
-
A novel method for determining internuclear distances and correlation times from nmr cross-relaxation rates
-
Davis, D. G. A Novel Method for Determining Internuclear Distances and Correlation Times from NMR Cross-Relaxation Rates. J. Am. Chem. Soc. 1987, 109, 3471-3472.
-
(1987)
J. Am. Chem. Soc.
, vol.109
, pp. 3471-3472
-
-
Davis, D.G.1
-
29
-
-
0032477283
-
Determination of relative n-hn, n-c′, cα-c′, and cα-hα effective bond lengths in a protein by nmr in a dilute liquid crystalline phase
-
Ottiger, M.; Bax, A. Determination of Relative N-HN, N-C′, Cα-C′, and Cα-Hα Effective Bond Lengths in a Protein by NMR in a Dilute Liquid Crystalline Phase. J. Am. Chem. Soc. 1998, 120, 12334-12341.
-
(1998)
J. Am. Chem. Soc.
, vol.120
, pp. 12334-12341
-
-
Ottiger, M.1
Bax, A.2
-
30
-
-
33646719091
-
Model-free approach to the interpretation of nuclear magnetic resonance relaxation in macromolecules. 1. Theory and range of validity
-
Lipari, G.; Szabo, A. Model-Free Approach to the Interpretation of Nuclear Magnetic Resonance Relaxation in Macromolecules. 1. Theory and Range of Validity. J. Am. Chem. Soc. 1982, 104, 4546-4559.
-
(1982)
J. Am. Chem. Soc.
, vol.104
, pp. 4546-4559
-
-
Lipari, G.1
Szabo, A.2
-
31
-
-
0029550886
-
Rotational diffusion anisotropy of human ubiquitin from 15n nmr relaxation
-
Tjandra, N.; Feller, S. E.; Pastor, R. W.; Bax, A. Rotational Diffusion Anisotropy of Human Ubiquitin from 15N NMR Relaxation. J. Am. Chem. Soc. 1995, 117, 12562-12566.
-
(1995)
J. Am. Chem. Soc.
, vol.117
, pp. 12562-12566
-
-
Tjandra, N.1
Feller, S.E.2
Pastor, R.W.3
Bax, A.4
-
32
-
-
0033596303
-
Distinguishing anisotropy and flexibility of the pentasaccharide lnf-1 in solution by carbon-13 nmr relaxation and hydrodynamic modeling
-
Rundlof, T.; Venable, R. M.; Pastor, R. W.; Kowalewski, J.; Widmalm, G. Distinguishing Anisotropy and Flexibility of the Pentasaccharide LNF-1 in Solution by Carbon-13 NMR Relaxation and Hydrodynamic Modeling. J. Am. Chem. Soc. 1999, 121, 11847-11854.
-
(1999)
J. Am. Chem. Soc.
, vol.121
, pp. 11847-11854
-
-
Rundlof, T.1
Venable, R.M.2
Pastor, R.W.3
Kowalewski, J.4
Widmalm, G.5
-
34
-
-
33846626899
-
A 1h-nmr thermometer suitable for cryoprobes
-
Findeisen, M.; Brand, T.; Berger, S. A 1H-NMR Thermometer Suitable for Cryoprobes. Magn. Reson. Chem. 2007, 45, 175-178.
-
(2007)
Magn. Reson. Chem.
, vol.45
, pp. 175-178
-
-
Findeisen, M.1
Brand, T.2
Berger, S.3
-
35
-
-
0001650729
-
One-dimensional noe experiments using pulsed field gradients
-
Stott, K.; Keeler, J.; Van, Q. N.; Shaka, A. J. One-Dimensional, NOE Experiments Using Pulsed Field Gradients. J. Magn. Reson. 1997, 125, 302-324.
-
(1997)
J. Magn. Reson.
, vol.125
, pp. 302-324
-
-
Stott, K.1
Keeler, J.2
Van, Q.N.3
Shaka, A.J.4
-
36
-
-
0033527320
-
A conformational study of the vicinally branched trisaccharide β-d-glcp-(1→2)[β-d-glcp-(1→ 3)]α-d-manp-ome by nuclear overhauser effect spectroscopy (noesy) and transverse rotating-frame overhauser effect spectroscopy (troesy) experiments
-
Kjellberg, A.; Widmalm, G. A Conformational Study of the Vicinally Branched Trisaccharide β-D-Glcp-(1→2)[β-D-Glcp-(1→ 3)]α-D-Manp-OMe by Nuclear Overhauser Effect Spectroscopy (NOESY) and Transverse Rotating-Frame Overhauser Effect Spectroscopy (TROESY) Experiments. Biopolymers 1999, 50, 391-399.
-
(1999)
Biopolymers
, vol.50
, pp. 391-399
-
-
Kjellberg, A.1
Widmalm, G.2
-
37
-
-
9544253911
-
Extending the limits of the selective 1d noesy experiment with an improved selective tocsy edited preparation function
-
Hu, H.; Bradley, S. A.; Krishnamurthy, K. Extending the Limits of the Selective 1D NOESY Experiment with an Improved Selective TOCSY Edited Preparation Function. J. Magn. Reson. 2004, 171, 201-206.
-
(2004)
J. Magn. Reson.
, vol.171
, pp. 201-206
-
-
Hu, H.1
Bradley, S.A.2
Krishnamurthy, K.3
-
38
-
-
0029270246
-
Short selective pulses for biochemical applications
-
Kupce, E.; Boyd, J.; Campbell, I. D. Short Selective Pulses for Biochemical Applications. J. Magn. Reson., Ser. B 1995, 106, 300-303.
-
(1995)
J. Magn. Reson., Ser. B
, vol.106
, pp. 300-303
-
-
Kupce, E.1
Boyd, J.2
Campbell, I.D.3
-
39
-
-
0042819665
-
Elimination of zero-quantum interference in two-dimensional nmr spectra
-
Thrippleton, M. J.; Keeler, J. Elimination of Zero-Quantum Interference in Two-Dimensional NMR Spectra. Angew. Chem., Int. Ed. 2003, 42, 3938-3941.
-
(2003)
Angew. Chem., Int. Ed.
, vol.42
, pp. 3938-3941
-
-
Thrippleton, M.J.1
Keeler, J.2
-
40
-
-
46149132175
-
An improved method for the determination of cross-relaxation rates from noe data
-
Macura, S.; Farmer, B. T., II; Brown, L. R. An Improved Method for the Determination of Cross-Relaxation Rates from NOE Data. J. Magn. Reson. 1986, 70, 493-499.
-
(1986)
J. Magn. Reson.
, vol.70
, pp. 493-499
-
-
Macura, S.1
Farmer II, B.T.2
Brown, L.R.3
-
41
-
-
0001929604
-
General strategies for total-lineshape-type spectral analysis of nmr spectra using integral-transform iterator
-
Laatikainen, R.; Niemitz, M.; Weber, U.; Sundelin, J.; Hassinen, T.; Vepsalainen, J. General Strategies for Total-Lineshape-Type Spectral Analysis of NMR Spectra Using Integral-Transform Iterator. J. Magn. Reson., Ser. A 1996, 120, 1-10.
-
(1996)
J. Magn. Reson., Ser. A
, vol.120
, pp. 1-10
-
-
Laatikainen, R.1
Niemitz, M.2
Weber, U.3
Sundelin, J.4
Hassinen, T.5
Vepsalainen, J.6
-
42
-
-
0002602864
-
Measurement of j(h,h) and long-range j(x,h) coupling constants in small molecules
-
Meissner, A.; Sørensen, O. W. Measurement of J(H,H) and Long-Range J(X,H) Coupling Constants in Small Molecules. Broadband XLOC and J-HMBC. Magn. Reson. Chem. 2001, 39, 49-52.
-
(2001)
Broadband XLOC and J-HMBC. Magn. Reson. Chem.
, vol.39
, pp. 49-52
-
-
Meissner, A.1
Sørensen, O.W.2
-
43
-
-
0041894484
-
Hecade: Hmqc-and hsqc-based 2d nmr experiments for accurate and sensitive determination of heteronuclear coupling constants from e.cosy-type cross peaks
-
Kozminski, W.; Nanz, D. HECADE: HMQC-and HSQC-Based 2D NMR Experiments for Accurate and Sensitive Determination of Heteronuclear Coupling Constants from E.COSY-Type Cross Peaks. J. Magn. Reson. 1997, 124, 383-392.
-
(1997)
J. Magn. Reson.
, vol.124
, pp. 383-392
-
-
Kozminski, W.1
Nanz, D.2
-
44
-
-
58149362694
-
An improved diffusion-ordered spectroscopy experiment incorporating bipolar-gradient pulses
-
Wu, D. H.; Chen, A. D.; Johnson, C. S. An Improved Diffusion-Ordered Spectroscopy Experiment Incorporating Bipolar-Gradient Pulses. J. Magn. Reson., Ser. A 1995, 115, 260-264.
-
(1995)
J. Magn. Reson., Ser. A
, vol.115
, pp. 260-264
-
-
Wu, D.H.1
Chen, A.D.2
Johnson, C.S.3
-
45
-
-
33646376290
-
Spin diffusion measurements: Spin echoes in the presence of a time-dependent field gradient
-
Stejskal, E. O.; Tanner, J. E. Spin Diffusion Measurements: Spin Echoes in the Presence of a Time-Dependent Field Gradient. J. Chem. Phys. 1965, 42, 288-292.
-
(1965)
J Chem. Phys.
, vol.42
, pp. 288-292
-
-
Stejskal, E.O.1
Tanner, J.E.2
-
46
-
-
0035744178
-
Accurate measurement of translational diffusion coefficients: A practical method to account for nonlinear gradients
-
Damberg, P.; Jarvet, J.; Graslund, A. Accurate Measurement of Translational Diffusion Coefficients: A Practical Method to Account for Nonlinear Gradients. J. Magn. Reson. 2001, 148, 343-348.
-
(2001)
J. Magn. Reson.
, vol.148
, pp. 343-348
-
-
Damberg, P.1
Jarvet, J.2
Graslund, A.3
-
47
-
-
34447569487
-
A new decoupling method for accurate quantification of polyethylene copolymer composition and triad sequence distribution with 13c nmr
-
Zhou, Z.; Kummerle, R.; Qiu, X.; Redwine, D.; Cong, R.; Taha, A.; Baugh, D.; Winniford, B. A New Decoupling Method for Accurate Quantification of Polyethylene Copolymer Composition and Triad Sequence Distribution with 13C NMR. J. Magn. Reson. 2007, 187, 225-233.
-
(2007)
J. Magn. Reson.
, vol.187
, pp. 225-233
-
-
Zhou, Z.1
Kummerle, R.2
Qiu, X.3
Redwine, D.4
Cong, R.5
Taha, A.6
Baugh, D.7
Winniford, B.8
-
48
-
-
67650500988
-
Charmm: The biomolecular simulation program
-
Brooks, B. R.; Brooks, C. L., III; MacKerell, A. D., Jr.; Nilsson, L.; Petrella, R. J.; Roux, B.; Won, Y.; Archontis, G.; Bartels, C.; Boresch, S.; et al. CHARMM: The Biomolecular Simulation Program. J. Comput. Chem. 2009, 30, 1545-1614.
-
(2009)
J. Comput. Chem.
, vol.30
, pp. 1545-1614
-
-
Brooks, B.R.1
Brooks III, C.L.2
MacKerell Jr., A.D.3
Nilsson, L.4
Petrella, R.J.5
Roux, B.6
Won, Y.7
Archontis, G.8
Bartels, C.9
Boresch, S.10
-
49
-
-
0037436001
-
Molecular dynamics simulations of an oligosaccharide using a force field modified for carbohydrates
-
Eklund, R.; Widmalm, G. Molecular Dynamics Simulations of an Oligosaccharide Using a Force Field Modified for Carbohydrates. Carbohydr. Res. 2003, 338, 393-398.
-
(2003)
Carbohydr. Res.
, vol.338
, pp. 393-398
-
-
Eklund, R.1
Widmalm, G.2
-
50
-
-
0000951252
-
Effect of electrostatic force truncation on interfacial and transport properties of water
-
Feller, S. E.; Pastor, R. W.; Rojnuckarin, A.; Bogusz, S.; Brooks, B. R. Effect of Electrostatic Force Truncation on Interfacial and Transport Properties of Water. J. Phys. Chem. 1996, 100, 17011-17020.
-
(1996)
J. Phys. Chem.
, vol.100
, pp. 17011-17020
-
-
Feller, S.E.1
Pastor, R.W.2
Rojnuckarin, A.3
Bogusz, S.4
Brooks, B.R.5
-
51
-
-
33646940952
-
Numerical integration of the cartesian equations of motion of a system with constraints: Molecular dynamics of n-alkanes
-
Ryckaert, J.-P.; Ciccotti, G.; Berendsen, H. J. Numerical Integration of the Cartesian Equations of Motion of a System With Constraints: Molecular Dynamics of n-Alkanes. J. Comput. Phys. 1977, 23, 327-341.
-
(1977)
J. Comput. Phys.
, vol.23
, pp. 327-341
-
-
Ryckaert, J.-P.1
Ciccotti, G.2
Berendsen, H.J.3
-
52
-
-
6444220229
-
System-size dependence of diffusion coefficients and viscosities from molecular dynamics simulations with periodic boundary conditions
-
Yeh, I.-C.; Hummer, G. System-Size Dependence of Diffusion Coefficients and Viscosities From Molecular Dynamics Simulations With Periodic Boundary Conditions. J. Phys. Chem. B 2004, 108, 15873-15879.
-
(2004)
J. Phys. Chem. B
, vol.108
, pp. 15873-15879
-
-
Yeh, I.-C.1
Hummer, G.2
-
53
-
-
77957311433
-
Comparing simulated and experimental translation and rotation constants: Range of validity for viscosity scaling
-
Venable, R. M.; Hatcher, E.; Guvench, O.; MacKerell, A. D., Jr.; Pastor, R. W. Comparing Simulated and Experimental Translation and Rotation Constants: Range of Validity for Viscosity Scaling. J. Phys. Chem. B 2010, 114, 12501-12507.
-
(2010)
J. Phys. Chem. B
, vol.114
, pp. 12501-12507
-
-
Venable, R.M.1
Hatcher, E.2
Guvench, O.3
MacKerell Jr., A.D.4
Pastor, R.W.5
-
54
-
-
84891354844
-
-
Network Theory, Ltd.: United Kingdom
-
Eaton, J. W.; Bateman, D.; Hauberg, S. GNU Octave Manual, version 3; Network Theory, Ltd.: United Kingdom, 2008.
-
(2008)
GNU Octave Manual Version
, vol.3
-
-
Eaton, J.W.1
Bateman, D.2
Hauberg, S.3
-
55
-
-
10044298750
-
Correlated c-c and c-o bond conformations in saccharide hydroxymethyl groups: Parametrization and application of redundant 1h-"1h, 13c-1h, and 13c-13c nmr j-couplings
-
Thibaudeau, C.; Stenutz, R.; Hertz, B.; Klepach, T.; Zhao, S.; Qingquan, W.; Carmichael, I.; Serianni, A. S. Correlated C-C and C-O Bond Conformations in Saccharide Hydroxymethyl Groups: Parametrization and Application of Redundant 1H-1H, 13C-1H, and 13C-13C NMR J-Couplings. J. Am. Chem. Soc. 2004, 126, 15668-15685.
-
(2004)
J. Am. Chem. Soc.
, vol.126
, pp. 15668-15685
-
-
Thibaudeau, C.1
Stenutz, R.2
Hertz, B.3
Klepach, T.4
Zhao, S.5
Qingquan, W.6
Carmichael, I.7
Serianni, A.S.8
-
56
-
-
77955111339
-
Population distribution of flexible molecules from maximum entropy analysis using different priors as background information: Application to the ,ψ-conformational space of the α-(1→2)-linked mannose disaccharide present in n-and o-linked glycoprotein
-
Sawen, E.; Massad, T.; Landersjo, C.; Damberg, P.; Widmalm, G. Population Distribution of Flexible Molecules from Maximum Entropy Analysis using Different Priors as Background Information: Application to the ,ψ-Conformational Space of the α-(1→2)-Linked Mannose Disaccharide Present in N-and O-Linked Glycoprotein. Org. Biomol. Chem. 2010, 8, 3684-3695.
-
(2010)
Org. Biomol. Chem.
, vol.8
, pp. 3684-3695
-
-
Sawen, E.1
Massad, T.2
Landersjo, C.3
Damberg, P.4
Widmalm, G.5
-
57
-
-
17444392480
-
Structure in liquid water: A study of spatial distribution functions
-
Svishchev, I. M.; Kusalik, P. G. Structure in Liquid Water: A Study of Spatial Distribution Functions. J. Chem. Phys. 1993, 99, 3049-3058.
-
(1993)
J Chem. Phys.
, vol.99
, pp. 3049-3058
-
-
Svishchev, I.M.1
Kusalik, P.G.2
-
58
-
-
0343811731
-
Internal motions and hydration of sucrose in a diluted water solution
-
Engelsen, S. B.; Perez, S. Internal Motions and Hydration of Sucrose in a Diluted Water Solution. J. Mol. Graphics Modell. 1997, 15, 122-131.
-
(1997)
J. Mol. Graphics Modell.
, vol.15
, pp. 122-131
-
-
Engelsen, S.B.1
Perez, S.2
-
59
-
-
84985666143
-
Conformations of the hydroxymethyl group in crystalline aldohexopyranoses
-
Marchessault, R. H.; Perez, S. Conformations of the Hydroxymethyl Group in Crystalline Aldohexopyranoses. Biopolymers 1979, 18, 2369-2374.
-
(1979)
Biopolymers
, vol.18
, pp. 2369-2374
-
-
Marchessault, R.H.1
Perez, S.2
-
60
-
-
0003016299
-
Crystallographic studies of carbohydrates
-
Jeffrey, G. A. Crystallographic Studies of Carbohydrates. Acta Crystallogr., Sect. B 1990, 46, 89-103.
-
(1990)
Acta Crystallogr. Sect. B
, vol.46
, pp. 89-103
-
-
Jeffrey, G.A.1
-
61
-
-
18444364010
-
Concerning the tumbling motion of disaccharides in aqueous solution
-
Berry, J. M.; Hall, L. D.; Wong, K. F. Concerning the Tumbling Motion of Disaccharides in Aqueous Solution. Carbohydr. Res. 1977, 56, C16-C20.
-
(1977)
Carbohydr. Res.
, vol.56
-
-
Berry, J.M.1
Hall, L.D.2
Wong, K.F.3
-
62
-
-
0002676168
-
Methyl β-lactoside: 600-mhz 1h-and 75-mhz 13c-n.m.r. Studies of 2h-and 13cenriched compounds
-
Hayes, M. L.; Serianni, A. S.; Barker, R. Methyl β-Lactoside: 600-MHz 1H-and 75-MHz 13C-N.M.R. Studies of 2H-and 13CEnriched Compounds. Carbohydr. Res. 1982, 100, 87-101.
-
(1982)
Carbohydr. Res.
, vol.100
, pp. 87-101
-
-
Hayes, M.L.1
Serianni, A.S.2
Barker, R.3
-
63
-
-
0001331889
-
Thermal offset viscosities of liquid h2o d2o and t2o
-
Cho, C. H.; Urquidi, J.; Singh, S.; Robinson, G. W. Thermal Offset Viscosities of Liquid H2O, D2O, and T2O. J. Phys. Chem. B 1999, 103, 1991-1994.
-
(1999)
J. Phys. Chem. B
, vol.103
, pp. 1991-1994
-
-
Cho, C.H.1
Urquidi, J.2
Singh, S.3
Robinson, G.W.4
-
64
-
-
0002433133
-
Techniques and applications of langevin dynamics simulations
-
In The Molecular Dynamics of Liquid Crystals; Luckhurst, G. R., Veracini, C. A., Eds.; Publishers: Dordrecht, The Netherlands
-
Pastor, R. W. Techniques and Applications of Langevin Dynamics Simulations. In The Molecular Dynamics of Liquid Crystals; Luckhurst, G. R., Veracini, C. A., Eds.; Kluwer Academic Publishers: Dordrecht, The Netherlands, 1994; pp 85-138.
-
(1994)
Kluwer Academic
, pp. 85-138
-
-
Pastor, R.W.1
-
65
-
-
0000130888
-
Modeling carbohydrate conformations from nmr data: Maximum entropy rotameric distribution about the c5-c6 bond in gentiobiose
-
Poppe, L. Modeling Carbohydrate Conformations from NMR Data: Maximum Entropy Rotameric Distribution about the C5-C6 bond in Gentiobiose. J. Am. Chem. Soc. 1993, 115, 8421-8426.
-
(1993)
J. Am. Chem. Soc.
, vol.115
, pp. 8421-8426
-
-
Poppe, L.1
-
66
-
-
84972839099
-
Soluble spin-label as a nmr relaxation probe in the study of the enzyme-substrate complexes
-
Rossi, C.; Marchettini, N. Soluble Spin-Label as a NMR Relaxation Probe in the Study of the Enzyme-Substrate Complexes. Spectrosc. Lett. 1994, 27, 1289-1298.
-
(1994)
Spectrosc. Lett.
, vol.27
, pp. 1289-1298
-
-
Rossi, C.1
Marchettini, N.2
-
67
-
-
0035942932
-
Molecular dynamics and nmr study of the α(1→4) and α(1→6) glycosidic linkages: Maltose and isomaltose
-
Best, R. B.; Jackson, G. E.; Naidoo, K. J. Molecular Dynamics and NMR Study of the α(1→4) and α(1→6) Glycosidic Linkages: Maltose and Isomaltose. J. Phys. Chem. B 2001, 105, 4742-4751.
-
(2001)
J. Phys. Chem. B
, vol.105
, pp. 4742-4751
-
-
Best, R.B.1
Jackson, G.E.2
Naidoo, K.J.3
-
68
-
-
84871554581
-
Stochastic modeling of flexible biomolecules applied to nmr relaxation. 2. Interpretation of complex dynamics in linear oligosaccharides
-
Kotsyubynskyy, D.; Zerbetto, M.; Soltesova, M.; Engstrom, O.; Pendrill, R.; Kowalewski, J.; Widmalm, G.; Polimeno, A. Stochastic Modeling of Flexible Biomolecules Applied to NMR Relaxation. 2. Interpretation of Complex Dynamics in Linear Oligosaccharides. J. Phys. Chem. B 2012, 116, 14541-14555.
-
(2012)
J. Phys. Chem. B
, vol.116
, pp. 14541-14555
-
-
Kotsyubynskyy, D.1
Zerbetto, M.2
Soltesova, M.3
Engstrom, O.4
Pendrill, R.5
Kowalewski, J.6
Widmalm, G.7
Polimeno, A.8
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