carlosjavierna's molecular-recognition [46 articles] Export Sort

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	A network of hydrogen bonds on the surface of TLR2 controls ligand positioning and cell signaling [My Copy] Journal of Biological Chemistry (10 December 2009) by Andrey V. Kajava, Thierry Vasselon posted to molecular-recognition hydrogen-bonds by carlosjavierna on 2009-12-11 14:13:51 as
	ADAM8 substrate specificity: Influence of pH on pre-processing and proteoglycan degradation [My Copy] Archives of Biochemistry and Biophysics, Vol. 491, No. 1-2. (18 November 2009), pp. 106-111. by Troii Hall, Lyle E. Pegg, Adele M. Pauley, H. David Fischer, Alfredo G. Tomasselli, Marc D. Zack posted to molecular-recognition by carlosjavierna on 2009-10-31 17:05:05 as
	Molecular Insights into the Interaction between α-Synuclein and Docosahexaenoic Acid [My Copy] Journal of Molecular Biology (08 September 2009) by Giorgia De Franceschi, Erica Frare, Luigi Bubacco, Stefano Mammi, Angelo Fontana, Patrizia P. de Laureto posted to parkinson molecular-recognition by carlosjavierna on 2009-10-26 02:20:10 as
	The Structure of Mycobacterium tuberculosis CYP125 [My Copy] Journal of Biological Chemistry, Vol. 284, No. 51. (18 December 2009), pp. 35524-35533. by Kirsty J. McLean, Pierre Lafite, Colin Levy, et al.Myles R. Cheesman, Natalia Mast, Irina A. Pikuleva, David Leys, Andrew W. Munro posted to molecular_basis molecular-recognition crystal-structure by carlosjavierna on 2009-10-22 17:53:37 as
	Structural basis of the interaction between chemokine stromal cell-derived factor-1/CXCL12 and its G-protein-coupled receptor CXCR4. [My Copy] The Journal of biological chemistry (18 October 2009) by Yutaka Kofuku, Chie Yoshiura, Takumi Ueda, et al.Hiroaki Terasawa, Takahiro Hirai, Sae Tominaga, Masako Hirose, Yoshitake Maeda, Hideo Takahashi, Yuya Terashima, Kouji Matsushima, Ichio Shimada posted to molecular-recognition by carlosjavierna on 2009-10-19 07:50:53 as along with 1 person tprpip
	Fatty Acid- and Retinoid-binding Proteins Have Distinct Binding Pockets for the Two Types of Cargo [My Copy] Journal of Biological Chemistry, Vol. 284, No. 51. (18 December 2009), pp. 35818-35826. by Rositsa Jordanova, Matthew R. Groves, Elena Kostova, Christian Woltersdorf, Eva Liebau, Paul A. Tucker posted to two-binding-sites molecular-recognition by carlosjavierna on 2009-10-14 16:20:33 as
	Analogues of the NAADP antagonist NED-19 indicate two binding sites on the NAADP receptor [My Copy] Journal of Biological Chemistry (13 October 2009) by Daniel Rosen, Alexander M. Lewis, Akiko Mizote, et al.Justyn M. Thomas, Parvinder K. Aley, Sridhar R. Vasudevan, Raman Parkesh, Antony Galione, Minoru Izumi, A. Ganesan, Grant C. Churchill posted to two-binding-sites molecular-recognition binding-sites by carlosjavierna on 2009-10-14 16:13:22 as
	Shape complementarity of protein-protein complexes at multiple resolutions [My Copy] Proteins: Structure, Function, and Bioinformatics, Vol. 75, No. 2. (2009), pp. 453-467. by Qing Zhang, Michel Sanner, Arthur J. Olson posted to protein-protein-interactions molecular-recognition by carlosjavierna on 2009-09-17 16:09:33 as
	Influence of the “Host−Guest” Interactions on the Mobility of Genistein/β-Cyclodextrin Inclusion Complex [My Copy] The Journal of Physical Chemistry B, Vol. 113, No. 31. (6 August 2009), pp. 11032-11038. by Vincenza Crupi, Domenico Majolino, Alessandro Paciaroni, Rosanna Stancanelli, Valentina Venuti posted to molecular-recognition host-guest-chemistry beta-cyclodextrin by carlosjavierna on 2009-09-05 03:15:30 as
	Structures of the G81A mutant form of the active chimera of ( S)-mandelate dehydrogenase and its complex with two of its substrates [My Copy] Acta Crystallographica Section D, Vol. 65, No. 6. (Jun 2009), pp. 543-552. by Narayanasami Sukumar, Asteriani Dewanti, Angelo Merli, Gian L. Rossi, Bharati Mitra, F. Scott Mathews posted to molecular-recognition gly ala by carlosjavierna on 2009-08-31 04:09:44 as
	A structural study of the interaction between the Dr haemagglutinin DraE and derivatives of chloramphenicol [My Copy] Acta Crystallographica Section D, Vol. 65, No. 6. (01 Jun 2009), pp. 513-522. by David M. Pettigrew, Pietro Roversi, Stephen G. Davies, Angela J. Russell, Susan M. Lea posted to molecular-recognition by carlosjavierna on 2009-08-31 03:48:28 as
	Combining crystallographic information and an aspherical-atom data bank in the evaluation of the electrostatic interaction energy in an enzyme--substrate complex: influenza neuraminidase inhibition [My Copy] Acta Crystallographica Section D, Vol. 65, No. 5. (May 2009), pp. 485-499. by Paulina M. Dominiak, Anatoliy Volkov, Adam P. Dominiak, Katarzyna N. Jarzembska, Philip Coppens posted to molecular-recognition electrostatic-interactions by carlosjavierna on 2009-08-31 03:43:21 as
	Mycobacterium tuberculosis pantothenate kinase: possible changes in location of ligands during enzyme action [My Copy] Acta Crystallographica Section D, Vol. 65, No. 4. (Apr 2009), pp. 312-325. by Bhaskar Chetnani, Satyabrata Das, Parimal Kumar, A. Surolia, M. Vijayan posted to molecular-recognition by carlosjavierna on 2009-08-30 01:13:47 as
	Specific Interactions between Four Molybdenum-Binding Proteins Contribute to Mo-Dependent Gene Regulation in Rhodobacter capsulatus [My Copy] J. Bacteriol., Vol. 191, No. 16. (15 August 2009), pp. 5205-5215. by Jessica Wiethaus, Alexandra Muller, Meina Neumann, et al.Sandra Neumann, Silke Leimkuhler, Franz Narberhaus, Bernd Masepohl posted to molecular-recognition by carlosjavierna on 2009-08-08 03:41:27 as
	The hallmark of AGC kinase functional divergence is its C-terminal tail, a cis-acting regulatory module [My Copy] Proceedings of the National Academy of Sciences, Vol. 104, No. 4. (23 January 2007), pp. 1272-1277. by Natarajan Kannan, Nina Haste, Susan S. Taylor, Andrew F. Neuwald posted to molecular-recognition by carlosjavierna on 2009-07-16 16:23:04 as
	Structural, functional and bioinformatic studies demonstrate the crucial role of an extended peptide binding site for the SH3 domain of yeast Abp1p [My Copy] J. Biol. Chem. (9 July 2009), M109.028431. by Elliott J. Stollar, Bianca Garcia, P. Andrew Chong, et al.Arianna Rath, Hong Lin, Julie D. Forman-Kay, Alan R. Davidson posted to molecular-recognition mutagenesis by carlosjavierna on 2009-07-16 00:11:40 as
	Binding-site geometry and flexibility in DC-SIGN demonstrated with surface force measurements [My Copy] Proceedings of the National Academy of Sciences, Vol. 106, No. 28. (14 July 2009), pp. 11524-11529. by Sindhu Menon, Kenneth Rosenberg, Sarah A. Graham, et al.Eliot M. Ward, Maureen E. Taylor, Kurt Drickamer, Deborah E. Leckband posted to molecular-recognition by carlosjavierna on 2009-07-15 23:59:50 as
	Determination of the Solution-Bound Conformation of an Amino Acid Binding Protein by NMR Paramagnetic Relaxation Enhancement: Use of a Single Flexible Paramagnetic Probe with Improved Estimation of Its Sampling Space [My Copy] Journal of the American Chemical Society, Vol. 131, No. 27. (15 July 2009), pp. 9532-9537. by Guillermo A. Bermejo, Marie-Paule Strub, Chien Ho, Nico Tjandra posted to conformations conformer molecular-recognition by carlosjavierna on 2009-07-11 20:35:44 as
	The R46Q, R131Q and R154H Polymorphs of Human DNA Glycosylase/β-Lyase hOgg1 Severely Distort the Active Site and DNA Recognition Site but do not Cause Unfolding [My Copy] Journal of the American Chemical Society, Vol. 131, No. 27. (15 July 2009), pp. 9506-9515. by Peter C. Anderson, Valerie Daggett posted to active-site arg arginine daggett gln glutamine his histidine molecular-recognition unfolding by carlosjavierna on 2009-07-11 20:32:17 as
	Solution Structure of Factor I-like Modules from Complement C7 Reveals a Pair of Follistatin Domains in Compact Pseudosymmetric Arrangement [My Copy] J. Biol. Chem., Vol. 284, No. 29. (17 July 2009), pp. 19637-19649. by Marie M. Phelan, Chuong-Thu Thai, Dinesh C. Soares, Ronald T. Ogata, Paul N. Barlow, Janice Bramham posted to molecular-recognition by carlosjavierna on 2009-07-11 16:54:53 as
	Plasminogen Substrate Recognition by the Streptokinase-Plasminogen Catalytic Complex Is Facilitated by Arg253, Lys256, and Lys257 in the Streptokinase beta-Domain and Kringle 5 of the Substrate [My Copy] J. Biol. Chem., Vol. 284, No. 29. (17 July 2009), pp. 19511-19521. by Anthony C. Tharp, Malabika Laha, Peter Panizzi, Michael W. Thompson, Pablo Fuentes-Prior, Paul E. Bock posted to arg arginine lys lysine molecular-recognition by carlosjavierna on 2009-07-11 16:53:59 as
	Structural Determinants of G-protein alpha Subunit Selectivity by Regulator of G-protein Signaling 2 (RGS2) [My Copy] J. Biol. Chem., Vol. 284, No. 29. (17 July 2009), pp. 19402-19411. by Adam J. Kimple, Meera Soundararajan, Stephanie Q. Hutsell, et al.Annette K. Roos, Daniel J. Urban, Vincent Setola, Brenda R. S. Temple, Bryan L. Roth, Stefan Knapp, Francis S. Willard, David P. Siderovski posted to molecular-recognition by carlosjavierna on 2009-07-11 16:51:31 as
	SitePredicting the cleavage of proteinase substrates [My Copy] Trends in Biochemical Sciences, Vol. 34, No. 7. (July 2009), pp. 319-323. by Jelle Verspurten, Kris Gevaert, Wim Declercq, Peter Vandenabeele posted to molecular-recognition proteins by carlosjavierna on 2009-07-11 14:29:22 as
	Role of the conserved water molecules in the binding of inhibitor to IMPDH-II (human): A study on the water mimic inhibitor design [My Copy] Journal of Molecular Structure: THEOCHEM, Vol. 908, No. 1-3. (30 August 2009), pp. 31-39. by Hridoy R. Bairagya, Bishnu P. Mukhopadhyay, S. Bhattacharya posted to molecular-recognition proteins by carlosjavierna on 2009-07-11 14:25:22 as
	Nucleoside Monophosphate Complex Structures of the Endonuclease Domain from the Influenza Virus Polymerase PA Subunit Reveal the Substrate Binding Site inside the Catalytic Center [My Copy] J. Virol., Vol. 83, No. 18. (15 September 2009), pp. 9024-9030. by Cong Zhao, Zhiyong Lou, Yu Guo, et al.Ming Ma, Yutao Chen, Shuaiyi Liang, Liang Zhang, Shoudeng Chen, Xuemei Li, Yingfang Liu, Mark Bartlam, Zihe Rao posted to molecular-recognition by carlosjavierna on 2009-07-09 20:45:15 as along with 1 person zwang
	CheZ binding interface of CheAS is located in the alpha-helix E [My Copy] J. Bacteriol. (6 July 2009), JB.00294-09. by Christopher O'Connor, Philip Matsumura, Andres Campos posted to alpha-helix molecular-recognition by carlosjavierna on 2009-07-08 17:58:25 as
	An A257V mutation in the Bacillus subtilis response regulator Spo0A prevents regulated expression of promoters with low consensus binding sites [My Copy] J. Bacteriol. (6 July 2009), JB.00590-09. by Steve D. Seredick, Barbara M. Seredick, David Baker, George B. Spiegelman posted to ala alanine binding-site binding-sites molecular-recognition mutagenesis val valine by carlosjavierna on 2009-07-08 17:54:52 as
	Spectroscopic and thermodynamic determination of three distinct binding sites for Co(II) ions in human serum albumin☆ [My Copy] Journal of Inorganic Biochemistry, Vol. 103, No. 7. (04 July 2009), pp. 1005-1013. by Magdalena Sokołowska, Małgorzata Wszelaka-Rylik, Jarosław Poznański, Wojciech Bal posted to molecular-recognition by carlosjavierna on 2009-07-07 04:11:55 as
	Influence of Magnesium Ion on the Binding of p53 DNA-Binding Domain to DNA-Response Elements [My Copy] J Biochem, Vol. 146, No. 1. (1 July 2009), pp. 77-85. by Yonglai Xue, Shuai Wang, Xizeng Feng posted to general molecular-recognition by carlosjavierna on 2009-07-07 03:28:39 as
	Structural Basis for the Sugar Nucleotide and Acyl-Chain Selectivity of Leptospira interrogans LpxA [My Copy] Biochemistry, Vol. 48, No. 26. (7 July 2009), pp. 6191-6201. by Lori I. Robins, Allison H. Williams, Christian R. Raetz posted to molecular-recognition structural-basis by carlosjavierna on 2009-07-06 03:21:50 as
	Small Molecules Bound to Unique Sites in the Target Protein Binding Cleft of Calcium-Bound S100B As Characterized by Nuclear Magnetic Resonance and X-ray Crystallography [My Copy] Biochemistry, Vol. 48, No. 26. (7 July 2009), pp. 6202-6212. by Thomas H. Charpentier, Paul T. Wilder, Melissa A. Liriano, et al.Kristen M. Varney, Shijun Zhong, Andrew Coop, Edwin Pozharski, Alexander D. Mackerell, Eric A. Toth, David J. Weber posted to crystal-structure molecular-recognition x-ray by carlosjavierna on 2009-07-06 03:21:14 as along with 1 person higueruelo
	Kinetic, Dynamic, Ligand Binding Properties, and Structural Models of a Dual-Substrate Specific Nudix Hydrolase from Schizosaccharomyces pombe [My Copy] Biochemistry, Vol. 48, No. 26. (7 July 2009), pp. 6224-6239. by John A. Garza, Udayar Ilangovan, Andrew P. Hinck, Larry D. Barnes posted to molecular-recognition by carlosjavierna on 2009-07-06 03:20:05 as
	New Insight into the Binding Mode of Peptide Ligands at Urotensin-II Receptor: Structure−Activity Relationships Study on P5U and Urantide [My Copy] Journal of Medicinal Chemistry, Vol. 52, No. 13. (9 July 2009), pp. 3927-3940. by Paolo Grieco, Alfonso Carotenuto, Pietro Campiglia, et al.Isabel Gomez-Monterrey, Luigia Auriemma, Marina Sala, Cristina Marcozzi, di Villa Bianca, Diego Brancaccio, Paolo Rovero, Paolo Santicioli, Stefania Meini, Carlo A. Maggi, Ettore Novellino posted to molecular-recognition by carlosjavierna on 2009-07-06 03:01:34 as
	Evidence for a distinct ligand binding site on tubulin discovered through inhibition by GDP of paclitaxel-induced tubulin assembly in the absence of exogenous GTP [My Copy] Archives of Biochemistry and Biophysics, Vol. 484, No. 1. (01 April 2009), pp. 55-62. by Elizabeth Wilcox, Connor Mcgrath, Andrei V. Blokhin, Rick Gussio, Ernest Hamel posted to molecular-recognition by carlosjavierna on 2009-06-24 18:06:54 as
	Characterization of inhibitor binding to human kinesin spindle protein by site-directed mutagenesis [My Copy] Archives of Biochemistry and Biophysics, Vol. 484, No. 1. (01 April 2009), pp. 1-7. by Gary C. Marshall, Maricel Torrent, Olusegun Williams, Kelly A. Hamilton, Carolyn A. Buser posted to molecular-recognition mutagenesis by carlosjavierna on 2009-06-24 18:05:28 as
	Physicochemical Study of the Complexation of Pterostilbene by Natural and Modified Cyclodextrins [My Copy] Journal of Agricultural and Food Chemistry, Vol. 57, No. 12. (24 June 2009), pp. 5294-5300. by José M. López-Nicolás, Pilar Rodríguez-Bonilla, Lorena Méndez-Cazorla, Francisco García-Carmona posted to cyclodextrin molecular-recognition by carlosjavierna on 2009-06-21 05:45:45 as
	Structural insight into the binding mode between the targeting domain of ALE-1 (92AA) and pentaglycine of peptidoglycan [My Copy] Protein Engineering, Design and Selection, Vol. 22, No. 7. (1 July 2009), pp. 385-391. by Hideki Hirakawa, Hidenori Akita, Tamaki Fujiwara, Motoyuki Sugai, Satoru Kuhara posted to gly molecular-recognition peptides by carlosjavierna on 2009-06-21 05:44:35 as
	An Immunogenic, Surface-Exposed Domain of Haemophilus ducreyi Outer Membrane Protein HgbA Is Involved in Hemoglobin Binding [My Copy] Infect. Immun., Vol. 77, No. 7. (1 July 2009), pp. 3065-3074. by Igor Nepluev, Galyna Afonina, William G. Fusco, et al.Isabelle Leduc, Bonnie Olsen, Brenda Temple, Christopher Elkins posted to molecular-recognition by carlosjavierna on 2009-06-21 05:08:28 as
	Mycobacterium avium subsp. paratuberculosis Fibronectin Attachment Protein Activates Dendritic Cells and Induces a Th1 Polarization [My Copy] Infect. Immun., Vol. 77, No. 7. (1 July 2009), pp. 2979-2988. by Jun S. Lee, Sung J. Shin, Michael T. Collins, et al.In D. Jung, Young-Il Jeong, Chang-Min Lee, Yong K. Shin, Daejin Kim, Yeong-Min Park posted to molecular-recognition by carlosjavierna on 2009-06-21 05:07:17 as
	ResDE-Dependent Regulation of Enterotoxin Gene Expression in Bacillus cereus: Evidence for Multiple Modes of Binding for ResD and Interaction with Fnr [My Copy] J. Bacteriol., Vol. 191, No. 13. (1 July 2009), pp. 4419-4426. by Julia Esbelin, Jean Armengaud, Assia Zigha, Catherine Duport posted to molecular-recognition by carlosjavierna on 2009-06-15 23:42:56 as
	N-Acetylglucosamine Recognition by a Family 32 Carbohydrate-Binding Module from Clostridium perfringens NagH [My Copy] Journal of Molecular Biology, Vol. 390, No. 2. (10 July 2009), pp. 208-220. by Elizabeth Ficko-Blean, Alisdair B. Boraston posted to molecular-recognition by carlosjavierna on 2009-06-14 02:17:04 as
	Investigation of enantiomer recognition of molecularly imprinted polymeric monoliths in pressurized capillary electrochromatography screening the amino acids and their derivatives [My Copy] Journal of Chromatography A (15 May 2009) by Min Li, Xucong Lin, Zenghong Xie posted to chiral-recognition molecular-recognition by carlosjavierna on 2009-06-08 21:51:28 as
	Molecular basis of substrate selection by the N-end rule adaptor protein ClpS [My Copy] Proceedings of the National Academy of Sciences, Vol. 106, No. 22. (2 June 2009), pp. 8888-8893. by Giselle Román-Hernández, Robert A. Grant, Robert T. Sauer, Tania A. Baker posted to molecular-recognition molecular_basis by carlosjavierna on 2009-06-03 14:16:43 as
	AR Inhibitors Identified by High-Throughput Microscopy Detection of Conformational Change and Subcellular Localization [My Copy] ACS Chemical Biology, Vol. 4, No. 3. (20 March 2009), pp. 199-208. by Jeremy O. Jones, Frank W. An, Marc I. Diamond posted to conformational-change host-guest host-guest-chemistry molecular-recognition by carlosjavierna on 2009-03-22 03:55:07 as
	The Molecular Basis of Species-Specific Ligand Activation of Trace Amine-Associated Receptor 1 (TAAR1) [My Copy] ACS Chemical Biology, Vol. 4, No. 3. (20 March 2009), pp. 209-220. by Edwin S. Tan, John C. Naylor, Eli S. Groban, et al.James R. Bunzow, Matthew P. Jacobson, David K. Grandy, Thomas S. Scanlan posted to host-guest host-guest-chemistry molecular-recognition by carlosjavierna on 2009-03-22 03:53:05 as
	Beyond Picomolar Affinities: Quantitative Aspects of Noncovalent and Covalent Binding of Drugs to Proteins [My Copy] Journal of Medicinal Chemistry, Vol. 0, No. 0. (0000) by Adam J. Smith, Xiyun Zhang, Andrew G. Leach, K. N. Houk posted to molecular-recognition perpective by carlosjavierna on 2009-02-05 17:36:07 as along with 2 people sschurer higueruelo

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review	103
arg	70
arginine	61
folding	61
molecular-dynamics-simulations	59
molecular-dynamics	56
proteins	55
molecular-recognition	46
general	44
por-conseguir	43
phosphorilation	36
crystal-structure	34
molecular-modeling	34
tyr	32
cys	31
lys	29
cysteine	28
beta-lactamase	28
ser	28
tyrosine	26
mutagenesis	26
pro	26
his	25
proline	23
conformational-change	22
serine	22
lysine	22
thr	22
amino-acids	22
host-guest-chemistry	21
gly	21
phosphorylation	21
alpha-helix	20
disorder	20
peptides	20
histidine	19
threonine	19
ala	18
docking	18
phe	18
trp	17
protein	16
qmmm	16
x-ray	16
glycine	16
alanine	15
enantiomers	15
hydrogen-bonds	15
leu	14
mini-review	14
beta-sheet	13
conformational	13
qm-mm	12
cyclodextrin	12
modeling	12
md	12
tryptophan	12
qsar	11
proteinas	11
gln	10
unfolding	10
beta-cyclodextrin	10
leucine	10
glu	10
host-guest	10
free-energy	9
family	9
side-chain	9
enantioselectivity	8
peptide	8
conformational-states	8
conformer	8
glutamic-acid	8
phenylalanine	8
genetic_code	8
polyproline-ii	8
glycosylation	8
dft	8
val	7
glutamate	7
minireview	7
glutamine	7
binding-sites	7
helix	7
asp	7
mutation	7
conformations	6
dna	6
beta-hairpin	6
codon	6
binding-site	6
ile	6
methylation	6
amino-acid	6
met	6
aspartate	6
homology-modeling	5
binding-mode	5
chiral	5
monte-carlo	5
residue-analysis	5
sar	5
valine	5
potential-energy-surface	4
methionine	4
chaperone	4
replica-exchange-molecular-dynamics	4
force-fields	4
inclusion-complex	4
databases	4
ubiquitination	4
acetylation	4
force-field	4
aspartic-acid	4
honig-barry-h	4
tripeptide	4
residue	4
disulfide_bonds	4
hiv	4
water	4
coiled-coil	3
sequences	3
replica-exchange-md	3
unfolded	3
two-binding-sites	3
stereoselectivity	3
protein-folding	3
atoms-in-molecules	3
amber	3
isoleucine	3
peps	3
roux-benoit	3
cancer	3
protein-ligand-binding	3
rotamer	3
conformation	3
software	3
free-energy-landscape	3
perspective	3
roux	3
beta-turn	3
dipeptide	3
coil	3
active-site	3
karplus-m	3
open-to-closed	3
folding-rates	3
disordered-proteins	3
molecular_basis	3
chaperones	2
cconformational-analysis	2
rotamer-libraries	2
fe	2
alzheimer	2
stereochemistry	2
protein-protein-interactions	2
replica-exchange	2
thornton	2
electrostatic-interactions	2
b-sheet	2
flexibility	2
structural-basis	2
kenethmerz	2
asn	2
hobza	2
dynamics	2
carbon-nanotubes	2
metallo-beta-lactamase	2
hydrophobic	2
basico	2
chiral-recognition	2
protein-engineering	2
ff	2
disulfide	2
parkinson	2
asparagine	2
thorntonjm	2
featured-article	2
prion	2
misfolding	2
web-tools	2
aromatic-residues	2
hobzapavel	2
beta-hairpins	2
beta-bulge	2
desorden	2
structure-activity-relationship	2
potential-of-mean-force	2
principal-component-analysis	2
pca	2
beta-lactam-antibiotic-resistance	2
carbapenemases	2
nanotubes	2
ubiquitylation	2
hydrophobic-interactions	2
comformational-population	2
levitt	2
hydrophobicity	2
enzimas	2
enzyme-substrate-complex	1
binding_energy	1
density-functionals	1
amino_acid_sequence	1
pro-chirality	1
bernardrbrooks	1
markae	1
targeted-molecular-dynamics	1
first-principles-molecular-dynamics	1
amyloid-b-protein	1
abinitio-md	1
hiv-1-integrase	1
dimethylation	1
diastereoselectivity	1
conformation-transitions	1
cephalosporinase	1
gamma-turns	1
two-active-sites	1
protein-folding-rates	1
docking-methods	1
shv-1	1
argi	1
coarse-grained-md	1
recognition	1
solvation	1
iron-containing-proteins	1
similarity-methods	1
change	1
hydrogen_bond	1
synthesis	1
jirisponer	1
dihedral	1
enantiomeric-separation	1
fingerprint-methods	1
regioselectivity	1
pmf	1
clinical-diagnosis	1
carbohydrates	1
induced-fit	1
beta_lactamase	1
daggett	1
gilsonmk	1
thanslocation	1
conformational_changes	1
rna	1
post-translational-modification	1
conformational-free-energy-surface	1
trp-cage	1
mass-spectrometry	1
protein-architecture	1
c-terminal-domain	1
alfa-cyclodextrin	1
clbrooksiii	1
libraries	1
michaellklein	1
chemistry	1
salt-bridge	1
main-chain-flexibility	1
binding	1
bayly-christopher-i	1
serina	1
simulations	1
dimers	1
therapeutics	1
case	1
diabetes	1
molecular_dynamics_simulations	1
heme	1
conserved-residues	1
protein-drug-interactions	1
thermodynamics	1
angel-e-garcia	1
signal_peptides	1
inouey	1
autodock	1
ciq	1
merzkm	1
pharmacology	1
umbrella-sampling	1
douglasjtobias	1
dipeptides	1
first-principles-md	1
car-parrinello-md	1
deacetylation	1
lxxll-motif	1
pbp1b	1
ethanol-solution	1
alanemark	1
friesnerr	1
his-heme	1
groesl	1
xavierperiole	1
catalytic_residues	1
protein-translocation	1
beta-lactam-antibiotics	1
austin	1
drug-design	1
cooperativity	1
computational-study	1
car-parrinello-molecular-dynamics	1
discrete-molecular-dynamics	1
perpective	1
deimination	1
jialigao	1
sulfated-b-cyclodextrin	1
bilayer	1
helix-bundles	1
hsa	1
aqueous-solubility	1
antibiotic	1
3d-qsar	1
mackerell	1
conformational-behavior	1
hummer	1
molecular	1
signal_peptide	1
conformational-energy-landscape	1
gly-gly-gly	1
goddardwaiii	1
ionic-peptides	1
drug-protein-interactions	1
fe-landscape	1
protein-dynamics	1
dna-carbon-nanotube	1
hiv-1	1
hydrogen-bondsdensity-functional-theory	1
crystal_structure	1
charmm	1
mutant	1
basis-sets	1
phosphoserine	1
nucleator	1
homology	1
free-energy-differences	1
refolding	1
porins	1
aqvist	1
dynamic	1
dillka	1
allosteric	1
gly-gly	1
pande-vijay-s	1
abinitio-molecular-dynamics	1
enantiomeric-excess	1
thermodynamic-studies	1
george-georgiou	1
side-chain-amino-acids	1
extended-spectrum-beta-lactamase	1
tuckermanme	1
coarse-grained-molecular-dynamics	1
mining-minima-method	1
polypeptides	1
chiral-separation	1
antibiotic_resistance	1
kinetics	1
phenilalanine	1
dipeptido	1
swope-william	1
drug-receptor-interactions	1
decarboxilation	1
carlssonj	1
pitera-jed-w	1
substrate-recognition	1
normal-mode-analysis	1
conformational_change	1
analysis	1
succination	1
superfamilies	1
mm-gbsa	1
ethanol	1
trp-zipper	1
donaldgtruhlar	1
inhibitors	1
metalloenzymes	1
computer-imulations	1
remd	1

carlosjavierna's molecular-recognition [46 articles] Export Sort

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