Tag paper1 [at least 200 articles] Export

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	Slightly Viscous Amino Acid Ionic Liquids: Synthesis, Properties, and Calculations [My Copy] The Journal of Physical Chemistry B, Vol. 0, No. 0. (0000) by Ling He, Guo-Hong Tao, Damon A. Parrish, Jean’ne M. Shreeve posted to paper1 ionic_liquids glycine dmg by whitead to the group Jiang Research Group on 2009-10-28 17:03:45 as
	An approach to computing electrostatic charges for molecules [My Copy] Journal of Computational Chemistry, Vol. 5, No. 2. (1984), pp. 129-145. by U. Chandra Singh, Peter A. Kollman posted to partial_charges paper1 atomic_charges by whitead to the group Jiang Research Group on 2009-10-19 05:25:50 as along with 4 people pavanghatty tovrstra dfgreen kimikazu
	Quantum Mechanical Continuum Solvation Models [My Copy] Chemical Reviews, Vol. 105, No. 8. (1 August 2005), pp. 2999-3094. by Jacopo Tomasi, Benedetta Mennucci, Roberto Cammi posted to quantum_solvation paper1 gaussian by whitead to the group Jiang Research Group on 2009-10-19 05:24:56 as along with 2 people flbarroso ucbcjbm
	VMD: Visual molecular dynamics [My Copy] Journal of Molecular Graphics, Vol. 14, No. 1. (February 1996), pp. 33-38. by W. Humphrey posted to vmd paper1 by whitead to the group Jiang Research Group on 2009-10-18 19:06:01 as along with 6 people csrocha r2s2 pavanghatty choonpeng RamuAnandakrishnan tji
	P<FONT SIZE='-2'>ACKMOL</FONT>: A package for building initial configurations for molecular dynamics simulations [My Copy] Journal of Computational Chemistry, Vol. 30, No. 13. (2009), pp. 2157-2164. by L. Martínez, R. Andrade, E. G. Birgin, J. M. Martínez posted to paper1 packmol molecular_dynamics by whitead to the group Jiang Research Group on 2009-10-18 19:01:35 as along with 2 people klexa middledomain
	Fast Parallel Algorithms for Short-Range Molecular Dynamics [My Copy] Journal of Computational Physics, Vol. 117, No. 1. (1 March 1995), pp. 1-19. by S. Plimpton posted to prelim paper1 molecular_dynamics lammps by whitead on 2009-10-18 19:00:03 as along with 4 people and 1 group cjryan ashaytan3 gferencz jheco Jiang Research Group
	Solvent Composition and Viscosity Effects on the Kinetics of CO Binding to Horse Myoglobin† [My Copy] Biochemistry, Vol. 37, No. 2. (1 January 1998), pp. 717-733. by Thomas Kleinert, Wolfgang Doster, Harald Leyser, Winfried Petry, Veronika Schwarz, Marcus Settles posted to paper1 kinetics enzyme by whitead to the group Jiang Research Group on 2009-10-18 18:48:01 as
	Free Energy Landscapes of Encounter Complexes in Protein-Protein Association [My Copy] Biophysical Journal, Vol. 76, No. 3. (March 1999), pp. 1166-1178. by C. Camacho posted to protein-protein paper1 hydration by whitead to the group Jiang Research Group on 2009-10-18 18:43:38 as along with 4 people flbarroso ras bicko dgront
	Thermoprotection by glycine betaine and choline [My Copy] Microbiology, Vol. 145, No. 9. (1 September 1999), pp. 2543-2548. by Teresa Caldas, Nathalie Demont-Caulet, Alexandre Ghazi, Gilbert Richarme posted to protein_aggregation paper1 glycine_betaine by whitead to the group Jiang Research Group on 2009-10-18 18:34:16 as
	Ultralow Fouling and Functionalizable Surface Chemistry Based on a Zwitterionic Polymer Enabling Sensitive and Specific Protein Detection in Undiluted Blood Plasma [My Copy] Analytical Chemistry, Vol. 80, No. 20. (15 October 2008), pp. 7894-7901. by Hana Vaisocherová, Wei Yang, Zheng Zhang, et al.Zhiqiang Cao, Gang Cheng, Marek Piliarik, Jiří Homola, Shaoyi Jiang posted to zwitterion paper1 nonfouling by whitead on 2009-10-18 18:18:18 as along with 1 group Jiang Research Group
	Strong Repulsive Forces between Protein and Oligo (Ethylene Glycol) Self-Assembled Monolayers: A Molecular Simulation Study [My Copy] Biophysical Journal, Vol. 89, No. 1. (July 2005), pp. 158-166. by J. Zheng posted to paper1 nonfouling molecular_dynamics by whitead on 2009-10-18 18:16:29 as along with 1 group Jiang Research Group
	Protein Adsorption on Oligo(ethylene glycol)-Terminated Alkanethiolate Self-Assembled Monolayers: The Molecular Basis for Nonfouling Behavior [My Copy] The Journal of Physical Chemistry B, Vol. 109, No. 7. (1 February 2005), pp. 2934-2941. by Lingyan Li, Shengfu Chen, Jie Zheng, Buddy D. Ratner, Shaoyi Jiang posted to peg paper1 nonnfouling by whitead on 2009-10-18 18:12:30 as along with 1 person and 1 group sjanusz Jiang Research Group
	Functionalizable surface platform with reduced nonspecific protein adsorption from full blood plasma—Material selection and protein immobilization optimization [My Copy] Biosensors and Bioelectronics, Vol. 24, No. 7. (15 March 2009), pp. 1924-1930. by Hana Vaisocherová, Zheng Zhang, Wei Yang, et al.Zhiqiang Cao, Gang Cheng, Allen D. Taylor, Marek Piliarik, Jiří Homola, Shaoyi Jiang posted to paper1 nonfouling jgroup by whitead on 2009-10-18 17:54:26 as along with 1 group Jiang Research Group
	Hydration of “Nonfouling” Functional Groups [My Copy] The Journal of Physical Chemistry B, Vol. 113, No. 1. (8 January 2009), pp. 197-201. by Jason C. Hower, Matthew T. Bernards, Shengfu Chen, Heng-Kwong Tsao, Yu-Jane Sheng, Shaoyi Jiang posted to paper1 molecular_dynamics hydration by whitead on 2009-10-18 17:45:10 as along with 1 group Jiang Research Group
	Interactions of the Osmolyte Glycine Betaine with Molecular Surfaces in Water: Thermodynamics, Structural Interpretation, and Prediction of m-Values [My Copy] Biochemistry, Vol. 0, No. 0. (0000) by Michael W. Capp, Laurel M. Pegram, Ruth M. Saecker, et al.Megan Kratz, Demian Riccardi, Timothy Wendorff, Jonathan G. Cannon, M. Thomas Record posted to water paper1 hydration glycine_betaine by whitead on 2009-10-09 23:54:48 as along with 1 person and 1 group qshao Jiang Research Group
	Hydration Water Dynamics Near Biological Interfaces† [My Copy] The Journal of Physical Chemistry B, Vol. 113, No. 13. (2 April 2009), pp. 4082-4092. by Margaret E. Johnson, Cecile Malardier-Jugroot, Rajesh K. Murarka, Teresa Head-Gordon posted to polarizable_molecular_dynamics paper1 molecular_dynamics hydration by whitead to the group Jiang Research Group on 2009-10-01 21:11:09 as along with 5 people and 1 group willard flbarroso Lombardo_7 kvilonen sobolevnrm baker-group
	Computational Investigation of the First Solvation Shell Structure of Interfacial and Bulk Aqueous Chloride and Iodide Ions† [My Copy] The Journal of Physical Chemistry B, Vol. 113, No. 13. (2 April 2009), pp. 4141-4146. by Collin D. Wick, Sotiris S. Xantheas posted to paper1 molecular_dynamics ion_hydration hydration by whitead to the group Jiang Research Group on 2009-10-01 21:10:48 as along with 1 person flbarroso
	Solvation Dynamics of Model Peptides Probed by Terahertz Spectroscopy. Observation of the Onset of Collective Network Motions [My Copy] Journal of the American Chemical Society, Vol. 131, No. 10. (18 March 2009), pp. 3752-3755. by Benjamin Born, Hermann Weingärtner, Erik Bründermann, Martina Havenith posted to peptide_solvation paper1 hydration by whitead to the group Jiang Research Group on 2009-10-01 18:34:56 as along with 1 person kafuitay
	Probability Distributions of Hydration Water Molecules around Polar Protein Atoms Obtained by a Database Analysis [My Copy] The Journal of Physical Chemistry B, Vol. 113, No. 32. (13 August 2009), pp. 11274-11292. by Daisuke Matsuoka, Masayoshi Nakasako posted to water_slaving protein pdb paper1 hydration by whitead on 2009-10-01 18:13:12 as along with 1 group Jiang Research Group
	Zwitterionic SAMs that Resist Nonspecific Adsorption of Protein from Aqueous Buffer [My Copy] Langmuir, Vol. 17, No. 9. (1 May 2001), pp. 2841-2850. by R. Erik Holmlin, Xiaoxi Chen, Robert G. Chapman, Shuichi Takayama, George M. Whitesides posted to spr sam paper1 nonfouling by whitead to the group Jiang Research Group on 2009-09-30 20:48:08 as
	Glycine betaine accumulation and induction of cold tolerance in strawberry (Fragaria X ananassa Duch.) plants [My Copy] Plant Science, Vol. 148, No. 2. (29 October 1999), pp. 175-183. by C. Rajashekar posted to paper1 glycine_betain applications by whitead to the group Jiang Research Group on 2009-09-30 18:44:14 as
	Osmoprotectants and cryoprotectants for Listeria monocytogenes [My Copy] Letters in Applied Microbiology, Vol. 30, No. 1. (2000), pp. 23-27. by D. O. Bayles, B. J. Wilkinson posted to tmg paper1 glycine_betain applications by whitead to the group Jiang Research Group on 2009-09-30 18:41:57 as along with 1 person qshao
	Growth of Lactococcus lactis strains at low water activity: correlation with the ability to accumulate glycine betaine [My Copy] International Journal of Food Microbiology, Vol. 55, No. 1-3. (10 April 2000), pp. 127-131. by J. O'Callaghan posted to tmg paper1 glycine_betaine applications by whitead to the group Jiang Research Group on 2009-09-30 18:39:38 as
	On the Stability of Amino Acid Zwitterions in the Gas Phase: The Influence of Derivatization, Proton Affinity, and Alkali Ion Addition [My Copy] Journal of the American Chemical Society, Vol. 122, No. 14. (1 April 2000), pp. 3458-3464. by Thomas Wyttenbach, Matthias Witt, Michael T. Bowers posted to zwitterions paper1 dmg by whitead to the group Jiang Research Group on 2009-09-30 18:33:06 as
	Water and Alanine: From Puddles(32) to Ponds(49) [My Copy] The Journal of Physical Chemistry B, Vol. 113, No. 43. (29 October 2009), pp. 14413-14420. by Jonathan M. Mullin, Mark S. Gordon posted to solvation_energy qm paper1 by whitead to the group Jiang Research Group on 2009-09-30 02:35:47 as along with 2 people carlosjavierna qshao
	Structural properties of water: Comparison of the SPC, SPCE, TIP4P, and TIP5P models of water [My Copy] The Journal of Chemical Physics, Vol. 123, No. 10. (2005), 104501. by Jan Zielkiewicz posted to water_struicture water tip4p spc paper1 by whitead to the group Jiang Research Group on 2009-09-24 20:13:28 as
	Angular geometries and other properties of hydrogen-bonded dimers: a simple electrostatic interpretation of the success of the electron-pair model [My Copy] Chem. Soc. Rev., Vol. 16 (1987), pp. 467-498. by A. C. Legon, D. J. Millen posted to paper1 hydrogen_bond definition by whitead to the group Jiang Research Group on 2009-09-24 20:10:17 as
	Transport properties of water at functionalized molecular interfaces [My Copy] The Journal of Chemical Physics, Vol. 131, No. 12. (2009), 125102. by Jun Feng, Ka Y. Wong, Kippi Dyer, B. Montgomery Pettitt posted to water transport paper1 diffusion by whitead to the group Jiang Research Group on 2009-09-24 16:57:41 as along with 1 person dlimmer
	How hydrophobic hydration responds to solute size and attractions: Theory and simulations [My Copy] The Journal of Chemical Physics, Vol. 131, No. 11. (2009), 115102. by Manoj V. Athawale, Sumanth N. Jamadagni, Shekhar Garde posted to paper1 hydration_metric hydration by whitead on 2009-09-18 09:04:45 as along with 1 person and 1 group dlimmer Jiang Research Group
	Dependence of the l-Alanyl-l-Alanine Conformation on Molecular Charge Determined from Ab Initio Computations and NMR Spectra [My Copy] The Journal of Physical Chemistry B, Vol. 112, No. 6. (1 February 2008), pp. 1796-1805. by Vladimir Sychrovsky, Milos Budesinsky, Ladislav Benda, et al.Vladimir Spirko, Zuzana Vokačova, Jaroslav Sebestik, Petr Bour posted to structure paper1 nmr by whitead to the group Jiang Research Group on 2009-09-12 22:32:45 as
	Theoretical study of solvent effect on intramolecular proton transfer of glycine [My Copy] Journal of Molecular Structure: THEOCHEM, Vol. 531, No. 1-3. (23 October 2000), pp. 267-282. by E. Kassab posted to proton_transfer paper1 glycine by whitead to the group Jiang Research Group on 2009-09-09 23:26:19 as
	Amino acid chemistry in dipolar aprotic solvents: dissociation constants and ambident reactivity [My Copy] The Journal of Organic Chemistry, Vol. 51, No. 13. (1 June 1986), pp. 2579-2585. by David L. Hughes, James J. Bergan, Edward J. J. Grabowski posted to solvation paper1 hydration amino_acid_chemistry by whitead to the group Jiang Research Group on 2009-09-09 23:20:55 as
	14N NMR relaxation times of several protein amino acids in aqueous solution—comparison with 17O NMR data and estimation of the relative hydration numbers in the cationic and zwitterionic forms [My Copy] Journal of Magnetic Resonance, Vol. 164, No. 2. (October 2003), pp. 294-303. by A. Troganis posted to water structure paper1 nmr hydration by whitead to the group Jiang Research Group on 2009-09-09 23:06:53 as
	Effects of solvents on the tautomerization of <I>N,N-</I>dimethylglycine [My Copy] Journal of Physical Organic Chemistry, Vol. 10, No. 12. (1997), pp. 898-900. by Allan D. Headley, Rita E. Corona, Eric T. Cheung posted to solvation paper1 hydration dmg by whitead to the group Jiang Research Group on 2009-09-09 23:06:17 as
	Low-temperature solid-state FTIR study of glycine, sarcosine and N,N-dimethylglycine: observation of neutral forms of simple [small alpha]-amino acids in the solid state [My Copy] Phys. Chem. Chem. Phys., Vol. 5, No. 15. (2003), pp. 3154-3161. by A. Gomez-Zavaglia, R. Fausto posted to solid_state paper1 glycine ftir by whitead to the group Jiang Research Group on 2009-09-09 23:00:59 as
	Anomalous Dynamics of Hydration Water in Carbohydrate Solutions [My Copy] The Journal of Physical Chemistry B, Vol. 113, No. 39. (1 October 2009), pp. 12999-13006. by Matías H. H. Pomata, Milton T. Sonoda, Munir S. Skaf, M. Dolores Elola posted to water structure paper1 molecular hydration dynamics by whitead to the group Jiang Research Group on 2009-09-09 17:56:04 as along with 1 person qshao
	High-kappa gate dielectrics: Current status and materials properties considerations [My Copy] Journal of Applied Physics, Vol. 89, No. 10. (2001), pp. 5243-5275. by G. D. Wilk, R. M. Wallace, J. M. Anthony posted to paper1 by ryde on 2009-08-25 08:07:05 as along with 3 people dankamongmen mrsmond eyliu
	On the Number of Water Molecules Necessary To Stabilize the Glycine Zwitterion [My Copy] Journal of the American Chemical Society, Vol. 117, No. 31. (1 August 1995), pp. 8159-8170. by Jan H. Jensen, Mark S. Gordon posted to water structure solvation quantum paper1 glycine by whitead to the group Jiang Research Group on 2009-08-14 17:23:11 as
	A new order parameter for tetrahedral configurations [My Copy] Molecular Physics: An International Journal at the Interface Between Chemistry and Physics, Vol. 93, No. 3. (1998), pp. 511-518. by Chau, A. J. Hardwick posted to water tetrahedral structure paper1 order by whitead to the group Jiang Research Group on 2009-08-13 18:34:55 as
	Relationship between structural order and the anomalies of liquid water [My Copy] Nature, Vol. 409, No. 6818. (18 January 2001), pp. 318-321. by Jeffrey R. Errington, Pablo G. Debenedetti posted to water structure paper1 by whitead to the group Jiang Research Group on 2009-08-13 18:33:31 as along with 1 person qshao
	Structure of the Alanine Hydration Shell as Probed by NMR Chemical Shifts and Indirect Spin−Spin Coupling [My Copy] The Journal of Physical Chemistry B, Vol. 113, No. 44. (5 November 2009), pp. 14698-14707. by Martin Dračínský, Jakub Kaminský, Petr Bouř posted to water structure paper1 nmr experiment alanine by whitead on 2009-07-07 20:13:24 as along with 4 people and 1 group ehesan kubikuk thegoose carlosjavierna Jiang Research Group
	Protonated Arginine and Protonated Lysine: Hydration and Its Effect on the Stability of Salt-Bridge Structures [My Copy] The Journal of Physical Chemistry B, Vol. 113, No. 29. (23 July 2009), pp. 9995-10000. by Bing Gao, Thomas Wyttenbach, Michael T. Bowers posted to water paper1 hydration experiments by whitead on 2009-07-06 21:13:13 as along with 1 person and 1 group carlosjavierna Jiang Research Group
	MODELING WATER, THE HYDROPHOBIC EFFECT, AND ION SOLVATION [My Copy] Annual Review of Biophysics and Biomolecular Structure, Vol. 34, No. 1. (2005), pp. 173-199. by Ken A. Dill, Thomas M. Truskett, Vojko Vlachy, Barbara H. Lee posted to water structure review paper1 model by whitead on 2009-06-29 08:12:46 as along with 2 people and 1 group Lombardo_7 Elena_Zubova Jiang Research Group
	Femtosecond solvation dynamics of water [My Copy] Nature, Vol. 369 (June 1994), pp. 471-473. by R. Jimenez, G. R. Fleming, P. V. Kumar, M. Maroncelli posted to water structure solvation paper1 femtosecond experiment dynamics by whitead on 2009-06-26 22:01:56 as along with 1 person and 1 group mlg Jiang Research Group
	A vector space model for automatic indexing [My Copy] Commun. ACM, Vol. 18, No. 11. (November 1975), pp. 613-620. by G. Salton, A. Wong, C. S. Yang posted to automaticindexing indexerconsistency indexing modelling paper1 thesis vectorspace by meikipp on 2009-06-26 21:01:18 as along with 36 people and 4 groups fer eabait minshady gavinhoran svozil fordparsons pcchang85 gerold baaic fisherp gilsonline ssn pdlug ville jcampos k12u yas mthomure ianturton taho naufraghi frohike noa codex chirayu_kong ransombriggs tomrowlands Nien diogomartins markymaypo thesis2007 Wurlitzer Tronhus mediallo takeha-e jaychoo Bioinformatics T_lab Adaptive-Web ARTFL
	Indexing Consistency: The Input/Output Function of Thesauri. [My Copy] College and Research Libraries, Vol. 52, No. 4. (0 1991), pp. 336-42. by Phyllis Reich, Erik J. Biever posted to indexerconsistency indexing paper1 thesaurus thesis by meikipp on 2009-06-26 20:57:47 as along with 1 person Scis0000002
	Interindexer Consistency Tests: A Literature Review and Report of a Test of Consistency in Indexing Visual Materials. [My Copy] Library and Information Science Research, An International Journal, Vol. 6, No. 2. (0 1984), pp. 155-77. by Karen Markey posted to indexerconsistency indexing paper1 paper2b paper4 thesis by meikipp on 2009-06-26 20:32:22 as
	Interindexer consistency in PsycINFO [My Copy] Journal of Librarianship and Information Science, Vol. 32, No. 1. (1 March 2000), pp. 4-8. by Kurt Leininger posted to indexerconsistency indexing paper1 thesis by meikipp on 2009-06-26 20:29:36 as
	Similarity measures in scientometric research: the Jaccard index versus Salton's cosine formula [My Copy] Inf. Process. Manage., Vol. 25, No. 3. (1989), pp. 315-318. by L. Hamers, Y. Hemeryck, G. Herweyers, et al.M. Janssen, H. Keters, R. Rousseau, A. Vanhoutte posted to informetrics paper1 patterns thesis by meikipp on 2009-06-26 20:21:01 as
	Indexing Overlap and Consistency between the "Avery Index to Architectural Periodicals" and the "Architectural Periodicals Index." [My Copy] Library Resources and Technical Services, Vol. 37, No. 1. (0 1993), pp. 19-44. by Angela Giral, Arlene G. Taylor posted to indexerconsistency indexing paper1 thesis by meikipp on 2009-06-26 20:16:24 as

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water	50
structure	40
hydration	25
thesis	22
climate_policy	17
dynamics	14
molecular	13
reflist	13
indexing	10
industrial_policy	10
alphaproteobacteria	9
molecular_dynamics	9
bioinformatics	8
evolution	8
glycine	8
indexerconsistency	7
paper2b	7
reconstruction	7
solvation	7
applications	6
dmg	6
nmr	6
business	5
glycine_betaine	5
nonfouling	5
phylogeny	5
analysis	4
coword	4
experiment	4
glycine_betain	4
informetrics	4
paper4	4
pet	4
qm	4
sustainability	4
technology	4
tmg	4
treatment-response	4
genome	3
hgt	3
informationretrieval	3
libraries	3
md	3
order	3
program	3
simulation	3
tip4p	3
transducin	3
0mgmezxr	2
1	2
2b6rvptx	2
amino_acid_chemistry	2
atomic_charges	2
classification	2
collaboration	2
convergence	2
definition	2
diffusion	2
enzyme	2
field	2
force	2
ftir	2
gaussian	2
hydrogen_bond	2
ijgzisa	2
ion_hydration	2
ionic_liquids	2
kinetics	2
mitochondria	2
model	2
modelling	2
molecular-imaging	2
neutron	2
packmol	2
paper2a	2
partial_charges	2
peptide_solvation	2
polarizable_molecular_dynamics	2
policy	2
proposal	2
protein-protein	2
proton_transfer	2
quantum	2
quantum_solvation	2
review	2
sam	2
scattering	2
solid_state	2
solvation_energy	2
spc	2
spr	2
technological_regimes	2
tetrahedral	2
thesaurus	2
transport	2
vmd	2
voluntary_approaches	2
water_struicture	2
web	2
zwitterions	2

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