flbarroso's titration [35 articles] Export

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	Isothermal Microcalorimetry to Investigate Non Specific Interactions in Biophysical Chemistry [My Copy] International Journal of Molecular Sciences, Vol. 10, No. 8. (28 July 2009), pp. 3283-3315. by Vincent Ball, Clarisse Maechling posted to titration protein-polyelectrolyte calorimetry by flbarroso on 2009-12-21 15:42:48 as
	Inclusion of ionization states of ligands in affinity calculations [My Copy] Proteins: Structure, Function, and Bioinformatics, Vol. 76, No. 1. (2009), pp. 138-150. by Serena Donnini, Alessandra Villa, Gerrit Groenhof, Alan E. Mark, Rik K. Wierenga, André H. Juffer posted to titration ph binding by flbarroso on 2009-11-11 10:31:10 as along with 5 people and 2 groups onufriev rbaron ibuch sobolevnrm RamuAnandakrishnan McCammon baker-group
	Very fast empirical prediction and rationalization of protein pK<SUB><FONT SIZE='-1'>a</FONT></SUB> values [My Copy] Proteins: Structure, Function, and Bioinformatics, Vol. 61, No. 4. (1 December 2005), pp. 704-721. by Hui Li, Andrew D. Robertson, Jan H. Jensen posted to titration pka electrostatics by flbarroso on 2009-09-04 02:44:08 as along with 9 people and 1 group Martin8223 franklu310 RamuAnandakrishnan gisle bicko sim82 barry sunhwan mschofie Bioinformatics
	Epik: a software program for pK prediction and protonation state generation for drug-like molecules [My Copy] Journal of Computer-Aided Molecular Design, Vol. 21, No. 12. (1 December 2007), pp. 681-691. by John Shelley, Anuradha Cholleti, Leah Frye, Jeremy Greenwood, Mathew Timlin, Makoto Uchimaya posted to titration pka drug-design by flbarroso on 2009-08-15 00:48:12 as
	A New Monte Carlo Method for the Titration of Molecules and Minerals [My Copy] Applied Parallel Computing. State of the Art in Scientific Computing (2009), pp. 66-72. by Christophe Labbez, Bo Jönsson posted to titration mineral mc electrostatics by flbarroso on 2009-08-14 16:05:10 as
	Focusing of the electrostatic potential at EF-hands of Calbindin D$_9k$: Titration of acidic residues [My Copy] Vol. 45 (2001), pp. 129-135. by T. Kesvatera, B. Jönsson, E. Thulin, S. Linse posted to titration pka ph electrostatics calbindin by flbarroso on 2009-08-14 15:59:11 as
	Measurement and Modelling of Sequence-specific pK$_a$ Values of Calbindin D$_9k$ [My Copy] J.~Mol. Biol., Vol. 259 (1996) by T. Kesvatera, B. Jönsson, E. Thulin, S. Linse posted to titration pka ph electrostatics calbindin by flbarroso on 2009-08-14 15:58:15 as
	The Role of Electrostatic Interactions in Calmodulin-Peptide Complex Formation [My Copy] Vol. 87 (2004) by I. André, T. Kesvatera, B. Jönsson, K. S. Aa Erfeldt, S. Linse posted to titration ph peptide electrostatics complexation calmodulin by flbarroso on 2009-08-14 15:56:33 as
	Enantioselective protonation [My Copy] Nat Chem, Vol. 1, No. 5. (August 2009), pp. 359-369. by Justin T. Mohr, Allen Y. Hong, Brian M. Stoltz posted to titration by flbarroso on 2009-08-10 18:02:49 as
	Protonation-induced transitions in a DNA brush [My Copy] Soft Matter, Vol. 5, No. 16. (2009), pp. 3010-3013. by Shay M. Rappaport, Shlomi Medalion, Yitzhak Rabin posted to dna electrostatics titration by flbarroso on 2009-08-04 22:07:12 as
	Carboxyl pK(a) values, ion pairs, hydrogen bonding, and the pH-dependence of folding the hyperthermophile proteins Sac7d and Sso7d. [My Copy] Journal of molecular biology, Vol. 372, No. 4. (28 September 2007), pp. 992-1008. by A. T. Clark, K. Smith, R. Muhandiram, S. P. Edmondson, J. W. Shriver posted to folding nmr pka protein titration by flbarroso on 2009-07-29 15:25:06 as
	PDBcal: a comprehensive dataset for receptor-ligand interactions with three-dimensional structures and binding thermodynamics from isothermal titration calorimetry. [My Copy] Chemical biology & drug design, Vol. 71, No. 6. (June 2008), pp. 529-532. by L. Li, J. J. Dantzer, J. Nowacki, B. J. O'Callaghan, S. O. Meroueh posted to binding bioinformatics calorimetry database thermodynamics titration by flbarroso on 2009-07-21 19:07:31 as along with 3 people massivemayhem higueruelo kintoki
	Measurement and Modelling of Sequence-specific pKaValues of Lysine Residues in Calbindin D9k [My Copy] Journal of Molecular Biology, Vol. 259, No. 4. (21 June 1996), pp. 828-839. by T. Kesvatera posted to calbindin calcium-binding mc nmr pka titration by flbarroso on 2009-07-21 15:41:16 as
	Titration properties and thermodynamics of the transition state for folding: comparison of two-state and multi-state folding pathways. [My Copy] Journal of molecular biology, Vol. 264, No. 2. (29 November 1996), pp. 377-389. by Y. J. Tan, M. Oliveberg, A. R. Fersht posted to folding titration by flbarroso on 2009-07-19 18:30:13 as
	Some Theoretical and Computational Aspects of the Inclusion of Proton Isomerism in the Protonation Equilibrium of Proteins [My Copy] The Journal of Physical Chemistry B, Vol. 105, No. 1. (1 January 2001), pp. 293-309. by Antonio M. Baptista, Claudio M. Soares posted to electrostatics pb pka titration by flbarroso on 2009-07-19 03:32:26 as
	Examination of Titratation Behavior [My Copy] Methods Enzymol., Vol. 11 (1967), pp. 715-734. by Y. Nozaki, C. Tanford posted to electrostatics pk pka titration by flbarroso on 2009-07-18 18:22:26 as
	pH-Dependent Processes in Protein [My Copy] Critical Reviews in Biochemistry and Molecular Biology, Vol. 18, No. 2. (January 1985), pp. 91-197. by James B. Matthew, Frank R. N. Gurd, Bertrand E. Garcia-Moreno, Margaret A. Flanagan, Keith L. March, Steven J. Shire posted to electrostatics ph pka titration by flbarroso on 2009-07-15 05:41:34 as along with 2 people zhaoyueju scampos
	Chapter 9 Analyzing Enzymatic pH Activity Profiles and Protein Titration Curves Using Structure-Based pKa Calculations and Titration Curve Fitting [My Copy] Methods in enzymology In Computer Methods, Part A, Vol. 454 (2009), pp. 233-258. by Jens E. Nielsen posted to electrostatics ph pka titration by flbarroso on 2009-07-15 05:37:59 as along with 4 people and 2 groups sobolevnrm scampos anuragsethi jmccammon McCammon baker-group
	The Influence of Dipole Moment Fluctuations on the Dielectric Increment of Proteins in Solution [My Copy] Proc. Nat. Acad. Sci. US, Vol. 38, No. 10. (October 1952), pp. 855-862. by John G. Kirkwood, John B. Shumaker posted to charge-regulation electrostatics titration by flbarroso on 2009-07-15 05:08:22 as along with 1 person mikaellund
	Structural origins of pH and ionic strength effects on protein stability. Acid denaturation of sperm whale apomyoglobin. [My Copy] Journal of molecular biology, Vol. 237, No. 5. (15 April 1994), pp. 602-614. by A. S. Yang, B. Honig posted to electrostatics folding myoglobin pka stability titration by flbarroso on 2009-07-15 04:13:31 as along with 2 people and 1 group cat_worth onufriev structural_bioinformatics
	Theory of Protein Titration Curves. II. Calculations for Simple Models at Low Ionic Strength [My Copy] Journal of the American Chemical Society, Vol. 79, No. 20. (1 October 1957), pp. 5340-5347. by Charles Tanford posted to electrostatics titration by flbarroso on 2009-07-15 04:03:11 as along with 1 person scampos
	Theory of Protein Titration Curves. I. General Equations for Impenetrable Spheres [My Copy] Journal of the American Chemical Society, Vol. 79, No. 20. (1 October 1957), pp. 5333-5339. by Charles Tanford, John G. Kirkwood posted to binding continnum dielectric electrostatics pka protein titration by flbarroso on 2009-07-15 03:44:28 as along with 3 people zenofchem mikaellund dfgreen
	Ion-ion correlation and charge reversal at titrating solid interfaces. [My Copy] Langmuir : the ACS journal of surfaces and colloids, Vol. 25, No. 13. (7 July 2009), pp. 7209-7213. by C. Labbez, B. Jönsson, M. Skarba, M. Borkovec posted to electrostatics titration by flbarroso on 2009-07-06 16:40:11 as
	Incorporating protein conformational flexibility into the calculation of pH-dependent protein properties. [My Copy] Biophysical journal, Vol. 72, No. 5. (May 1997), pp. 2075-2093. by E. G. Alexov, M. R. Gunner posted to flexibility titration by flbarroso on 2009-06-28 00:28:19 as along with 2 people sim82 RamuAnandakrishnan
	Conformation and hydrogen ion titration of proteins: a continuum electrostatic model with conformational flexibility. [My Copy] Biophys. J., Vol. 69, No. 5. (1 November 1995), pp. 1721-1733. by T. J. You, D. Bashford posted to continnum electrostatics titration by flbarroso on 2009-06-28 00:27:52 as along with 1 person sim82
	Identifying functional sites based on prediction of charged group behavior. [My Copy] Current protocols in bioinformatics / editoral board, Andreas D. Baxevanis ... [et al.], Vol. Chapter 8 (September 2004) by M. J. Ondrechen posted to binding electrostatics titration by flbarroso on 2009-06-15 16:23:06 as
	A fast and simple method to calculate protonation states in proteins. [My Copy] Proteins, Vol. 36, No. 4. (1 September 1999), pp. 474-483. by L. Sandberg, O. Edholm posted to electrostatics titration by flbarroso on 2009-03-28 21:05:39 as along with 1 person RamuAnandakrishnan
	Conformation and hydrogen ion titration of proteins: a continuum electrostatic model with conformational flexibility [My Copy] Vol. 69, No. 5. (1 November 1995), pp. 1721-1733. by T. J. You, D. Bashford posted to electrostatics flexibility titration by flbarroso on 2009-03-26 16:54:23 as
	Ionization Behavior of Acidic Residues in Calbindin D9k [My Copy] Proteins: Structure, Function, and Genetics, Vol. 37, No. 1. (1999), pp. 106-115. by Tõnu Kesvatera, Bo Jönsson, Eva Thulin, Sara Linse posted to calbindin dielectric electrostatics ph titration by flbarroso on 2009-01-26 10:58:31 as
	Protolytic equilibrium in lyophilic nanosized dispersions: Differentiating influence of the pseudophase and salt effects [My Copy] Pure Appl. Chem., Vol. 80, No. 7. (2008), pp. 1459-1510. by Nikolay O. Mchedlov-Petrossyan posted to electrostatics micelles titration by flbarroso on 2009-01-25 15:31:42 as
	Titration of Fatty Acids Solubilized in Cationic and Anionic Micelles. Calorimetry and Thermodynamic Modeling [My Copy] The Journal of Physical Chemistry B, Vol. 110, No. 7. (1 February 2006), pp. 3288-3293. by Olle Soderman, Bengt Jonsson, Gerd Olofsson posted to electrostatics micelles titration by flbarroso on 2009-01-25 15:19:33 as
	Titration of Fatty Acids Solubilized in Cationic, Nonionic, and Anionic Micelles. Theory and Experiment [My Copy] The Journal of Physical Chemistry B, Vol. 106, No. 13. (1 April 2002), pp. 3515-3522. by F. L. B. da Silva, Dan Bogren, Olle Soderman, Torbjörn Åkesson, Bo Jönsson posted to electrostatics fatty-acids micelles pk pka titration by flbarroso on 2009-01-25 15:17:41 as
	Effects of Salt Concentration on Formation and Dissociation of β-Lactoglobulin/Pectin Complexes [My Copy] Journal of Agricultural and Food Chemistry, Vol. 55, No. 25. (1 December 2007), pp. 10432-10436. by Xiaoyong Wang, Yu-Wen Wang, Chada Ruengruglikit, Qingrong Huang posted to beta-lactoglobulin electrostatics ionic-strength pectin protein-polyelectrolyte titration by flbarroso on 2009-01-22 11:51:13 as
	Towards Control of Aggregational Behaviour of α-Lactalbumin at Acidic pH [My Copy] Journal of Fluorescence, Vol. 16, No. 4. (1 July 2006), pp. 611-621. by Jane Pedersen, Peter Fojan, John Sorensen, Steffen Petersen posted to alfa-lactalbumin calcium-binding electrostatics structural-changes titration by flbarroso on 2009-01-22 11:22:04 as
	Interactions between furcellaran and the globular proteins bovine serum albumin and β-lactoglobulin [My Copy] Carbohydrate Polymers, Vol. 67, No. 1. (02 January 2007), pp. 116-123. by K. Laos, G. Brownsey, S. Ring posted to beta-lactoglobulin electrostatics fulleran on-the-wrong-side protein-polyelectrolyte spectroscopy titration albumin by flbarroso on 2009-01-22 10:24:20 as

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electrostatics	445
protein-protein	235
protein	179
folding	176
bioinformatics	117
md	116
binding	114
beta-lactoglobulin	87
protein-polyelectrolyte	82
pb	70
drug-design	68
continnum	67
force-fields	65
applications	62
solvation	56
lysozyme	56
docking	55
free_energy	54
calcium-binding	52
pka	50
water	50
prediction	48
modeling	45
hydrophobicity	43
database	39
whey	39
ph	36
titration	35
polyelectrolytes	32
albumin	31
mc	31
system_biology	31
calmodulin	31
protein-surface	30
alfa-lactalbumin	30
liquids	30
chitosan	29
aggregation	28
virial	28
dielectric	26
drug-delivery	26
reviews	25
membrane	25
coacervate	25
crystallization	25
simulation	24
complexation	24
charge-regulation	23
electrophoresis	21
born	21
polarizable	21
amyloid	20
colloids	20
enzyme	19
ion-binding	17
polymer	17
rmc	17
alzheimer	17
milk	17
light-scattering	16
peptide	16
barnase	16
pectin	15
dna	15
nanoparticles	14
microcapsules	14
cancer	14
van-der-waals	14
lactoferrin	13
ionic-strength	13
thrombin	12
hemoglobin	12
barstar	12
qmmm	11
antibody-antigen	10
acacia	10
solvent_accessible_surface	10
lattice_models	10
stability	10
channel	9
micelles	9
chromatography	9
sampling	9
hirudin	9
caseins	9
structural-changes	8
evolutive	8
calorimetry	8
mc-sampling	8
entropy	8
calbindin	8
nmr	8
protein-drug	8
strategic_planning	7
hpmodel	7
flexibility	7
protein-peptide	7
solubility	7
hiv	6
soft_matter	6
ph-effect	6
double_layer	6
pk	6
effective-potentials	6
x-ray	6
discontinuities	6
trypsin	6
actin	6
pi	6
activity_coefficients	5
protein-dna	5
immunoglobulin	5
osmotic	5
like-charged	5
hofmeister	5
homology	5
prion	5
molecular_dynamics_package	5
thermodynamics	5
separation	5
ribonuclease	5
ion-pairs	5
intermolecular-forces	5
patch	5
emulsions	5
fluid	5
myosin	5
ovalbumin	4
nacl	4
chymotrypsin	4
on-the-wrong-side	4
validation_protein	4
hamaker	4
spectroscopy	4
ion-ion_correlation	4
ca_chain_models	4
design	4
cytochrome	4
concentration-effect	4
chymotrypsinogen	3
statistical_potentials	3
myoglobin	3
nanostructure	3
ca	3
thrombomodulin	3
debye-huckel	3
genomics	3
protein_structure	3
afm	3
multiscale_modeling	3
protein_families	3
spectrometry	3
diseases	3
lie	3
widom	3
biological_physics	3
similarity	3
fluorescence	3
sedimentation	2
thioredoxin	2
non-electrostatic	2
nanotechnology	2
bacteria	2
allostery	2
igg	2
zeta-potential	2
cholesterol	2
protein-family	2
coarse_grain	2
amorphous	2
brushes	2
heparin	2
precipitation	2
fatty-acids	2
ferritin	2
influenza	2
gels	2
antioxidant	2
lectin	2
xanthan	2
chromatin	2
dvlo	2
sod	2
anesthetics	2
bd	2
blood	2
fibril	2
hyaluronic	2
oppositely-charged	2
mineral	2
chemistry2	2
food	2
clays	2
coarse-graining	2
nanotubes	2
sir	2
alignment	2
trichosurin	1
transferases	1
fructose	1
acetylcholinesterase	1
tanford-kirkwood	1
turbidity	1
rnasea	1
drude	1
prion_proteins	1
toxin	1
multi-objective	1
crambin	1
lidocaine	1
gel-filtration	1
cyclodextrin	1
protease	1
pvs	1
ovomucoid	1
epr	1
hydration	1
bapta	1
pectase	1
fasciculin	1
antimicrobial	1
diffraction	1
spectophotometry	1
ab_initio	1
cathepsin	1
science	1
zeolites	1
melatonin	1
cements	1
kallikrein	1
fulleran	1
aot	1
gramicidin	1
synechococcus	1
ionic_liquids	1
qsar	1
lipid_bilayers	1
microtubules	1
structural_genomics	1
calspermin	1
geometry	1
percolation	1
microscopic	1
p53	1
pollen	1
protein_g	1
dissociation	1
paa	1
potential_energy	1
alginate	1
proteome	1
raman	1
diabetes	1
interaction_forces	1
copper_proteins	1
generalized	1
lattice_boltzmann	1
ubiquitin	1
histone	1
ribosome	1
tyrosinase	1
dispersion	1
phase_diagram	1
contact_map	1
encapsulation	1
quantum_chemistry	1
pdmdaac	1
three-body	1
rhodamine	1
virus_structure_and_assembly	1
nmr_experiments	1
lennard_jones	1
vaccines	1
trifluoperazine	1
random_numbers	1
tryptase	1
lactoperoxidase	1
mean_field	1
peroxidase	1
antibiotics	1
surface_area	1
genomes	1
history	1
fibroin	1
transferrin	1
scattering	1
dendrimer	1
anemia	1
proteomics	1
chelator	1
peg	1
collagen	1
surfaces	1
coagulation	1
electron-transfer	1
peptides	1
tubulin	1
quantum_chemical	1
gama-globulin	1
tetracene	1
vesicle	1
enkephalin	1
silica_material	1
argon_gas	1
attractive_forces	1
crowding	1
psoriasin	1
histidines	1
calcyclin	1
polysaccharide	1
parallelization	1
pss	1
counterion-condensation	1
ras-raf	1
tannins	1
parkinson	1

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