rph's computation [16 articles] Export

Recent papers added to rph's library classified by the tag computation. You can also see everyone's computation.

	NOEMOL: integrated molecular graphics and the simulation of Nuclear Overhauser effects in NMR spectroscopy. [My Copy] Journal of molecular graphics, Vol. 7, No. 4. (December 1989) by M. Forster, C. Jones, B. Mulloy posted to computation noesy by rph on 2008-06-23 21:01:42 as
	Comparison of compuational methods for simulating nuclear Overhauser effects in NMR spectroscopy [My Copy] Journal of Computational Chemistry, Vol. 12, No. 3. (1991), pp. 292-300. by Mark J. Forster posted to computation noesy by rph on 2008-06-23 20:54:54 as
	A NOESY-HSQC simulation program, SPIRIT [My Copy] Journal of Biomolecular NMR, Vol. 11, No. 1. (1 January 1998), pp. 17-29. by Leiming Zhu, Jane H. Dyson, Peter E. Wright posted to computation noesy by rph on 2008-06-23 18:55:48 as
	Guidelines for the design of kinetic NOE experiments from computer simulation [My Copy] Magnetic Resonance in Chemistry, Vol. 25, No. 4. (1987), pp. 356-361. by M. P. Williamson posted to computation noesy by rph on 2008-06-23 16:52:24 as
	Ab initio simulations of protein-folding pathways by molecular dynamics with the united-residue model of polypeptide chains [My Copy] PNAS, Vol. 102, No. 7. (15 February 2005), pp. 2362-2367. by Adam Liwo, Mey Khalili, Harold A. Scheraga posted to computation folding molecular-dynamics by rph on 2008-06-17 21:30:46 as along with 1 person dgront
	CLOUDS, a protocol for deriving a molecular proton density via NMR [My Copy] PNAS, Vol. 99, No. 10. (14 May 2002), pp. 6707-6712. by Alexander Grishaev, Miguel Llinas posted to computation structure-determination by rph on 2008-06-17 21:24:53 as along with 1 person apaydin
	Folding Intermediate in the Villin Headpiece Domain Arises from Disruption of a N-Terminal Hydrogen-Bonded Network [My Copy] J. Am. Chem. Soc., Vol. 129, No. 11. (21 March 2007), pp. 3056-3057. by J. Khandogin, D. P. Raleigh, C. L. Brooks posted to computation folding-intermediates molecular-dynamics by rph on 2008-06-13 19:56:12 as
	Mapping long-range interactions in alpha-synuclein using spin-label NMR and ensemble molecular dynamics simulations. [My Copy] J Am Chem Soc, Vol. 127, No. 2. (19 January 2005), pp. 476-477. by M. M. Dedmon, K. Lindorff-Larsen, J. Christodoulou, M. Vendruscolo, C. M. Dobson posted to computation molecular-dynamics paramagnetic structure by rph on 2008-06-13 03:17:43 as along with 3 people charlesvardeman allmensch yxue
	Protein folding under confinement: A role for solvent [My Copy] Proceedings of the National Academy of Sciences, Vol. 104, No. 25. (19 June 2007), pp. 10430-10434. by Del Lucent, V. Vishal, Vijay S. Pande posted to computation folding by rph on 2008-06-04 18:49:40 as along with 4 people carlosjavierna melting cactus cjeans
	Backbone Dynamics ofEscherichia coliRibonuclease HI: Correlations with Structure and Function in an Active Enzyme [My Copy] Journal of Molecular Biology, Vol. 246, No. 1. (10 February 1995), pp. 144-163. by Arthur M. Mandel, Mikael Akke, Iii Palmer posted to computation dynamics model-free nmr-methods relaxation by rph on 2008-05-23 23:16:39 as
	Structure and Dynamics of Phospholamban in Solution and in Membrane Bilayer: Computer Simulations [My Copy] Biochemistry, Vol. 44, No. 6. (15 February 2005), pp. 1780-1792. by Y. Houndonougbo, K. Kuczera, G. S. Jas posted to computation imp by rph on 2008-04-23 18:13:07 as
	Simultaneous determination of protein structure and dynamics [My Copy] Nature, Vol. 433, No. 7022. (13 January 2005), pp. 128-132. by Kresten Lindorff-Larsen, Robert B. Best, Mark A. Depristo, Christopher M. Dobson, Michele Vendruscolo posted to computation structure by rph on 2008-04-22 20:14:03 as along with 15 people and 3 groups Diego_Prada xdeupi A_Coletta_Thesis karbak apaydin barry lillekatt baaden lna dgront allmensch daevans rsantana jlh64 biehl Structural Biology Group TorVergata structural_bioinformatics Bioinformatics
	Rapid Assessment of Protein Structural Stability and Fold Validation via NMR [My Copy] Methods in Enzymology, Vol. 394 (2005), pp. 142-175. by Bernd Hoffmann, Christian Eichmüller, Othmar Steinhauser, Robert Konrat posted to computation nmr proteomics by rph on 2008-03-26 02:09:46 as
	Automated Peak Picking and Peak Integration in Macromolecular NMR Spectra Using AUTOPSY [My Copy] Journal of Magnetic Resonance, Vol. 135, No. 2. (December 1998), pp. 288-297. by Reto Koradi, Martin Billeter, Max Engeli, Peter Guntert, Kurt Wuthrich posted to computation nmr by rph on 2008-03-25 16:45:50 as along with 2 people kumar_physics babakap
	Prediction of structures of multidomain proteins from structures of the individual domains. [My Copy] Protein Sci (22 December 2006) by Andrew M M. Wollacott, Alexandre Zanghellini, Paul Murphy, David Baker posted to bioinformatics computation proteomics structure by rph on 2008-03-17 17:46:35 as along with 5 people dgront wouterboomsma choonpeng zwang IrinaMoreira
	An estimate of spin diffusion in a spin subset: Application to iterative distance calculation from 3D 15N NOESY-HMQC [My Copy] Journal of Biomolecular NMR, Vol. 5, No. 2. (1 February 1995), pp. 193-201. by Thérèse E. Malliavin, Marc A. Delsuc, Vladislav Y. Orekhov, Alexander S. Arseniev posted to computation nmr noesy by rph on 2008-02-29 02:38:52 as

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nmr	143
nmr-methods	114
relaxation	98
review	74
imp	71
diffusion	47
methods	46
folding	45
dynamics	43
exchange	42
spin-dynamics	41
theory	40
noesy	40
groel	39
proteomics	38
micelles	38
biggies	35
nmr-diffusion	35
trosy	34
structure	32
detergents	32
protein	30
lipids	30
nmr-processing	28
ms-14	27
classic	24
chaperonin	22
screening	21
assignments	21
paramagnetic	18
automation	18
pulse-sequence-module	17
bioinformatics	17
dhfr	16
computation	16
relaxation-theory	16
structure-determination	15
19f	15
triple-resonance	15
unfolded	15
structural-genomics	15
bicelles	13
ms-13	13
imp-nmr	13
nmr-theory	13
biophysics	13
13c	12
dosy	12
pulse-design	10
protein-complexes	9
31p	9
nmr-hardware	8
membrane	8
sample-preparation	8
kinetics	8
hdhfr	8
hydration	8
bulk-magnetization	8
maximum-entropy	7
chemical-shift	7
ligand	7
folding-intermediates	6
c_diff	6
rdc	5
gpcr	5
hehaha	5
model-free	5
side-chain	5
roesy	5
tocsy	4
cell-free	4
groel-substrate	4
molecular-dynamics	4
methyl	4
ss-nmr	4
tthgroel	4
cs-perturbation	4
me-trosy	4
book	3
peptide	3
cross-correlation	3
molten-globule	3
interactions	3
j-couplings	3
aromatic	3
ligands	3
pfg	3
cross-saturation	3
amide	2
water-suppression	2
crystallography	2
selective-protonation	2
carbohydrate-nmr	2
aht	2
metal-binding	1
2h	1
109ag	1
microcoil	1
structure-prediction	1
radiation_damping	1
microprobe	1
nmr-software	1
amyloid	1
alt	1
torsion-angles	1
aggregates	1
hydrogen-bond	1
rna	1
ompx	1
labeling	1

rph's computation [16 articles] Export

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