A_Coletta_Thesis's protein [14 articles] Export

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

	A New Method to Detect Related Function Among Proteins Independent of Sequence and Fold Homology [My Copy] Journal of Molecular Biology, Vol. 323, No. 2. (18 October 2002), pp. 387-406. by Stefan Schmitt, Daniel Kuhn, Gerhard Klebe posted to structure protein by A_Coletta_Thesis on 2009-11-27 15:29:52 as along with 1 person and 1 group massivemayhem Structural Biology Group TorVergata
	Why similar protein sequences encode similar three-dimensional structures? [My Copy] Theoretical Chemistry Accounts: Theory, Computation, and Modeling (Theoretica Chimica Acta) by Szymon Kaczanowski, Piotr Zielenkiewicz posted to protein modeling folding by A_Coletta_Thesis on 2009-10-28 19:53:29 as along with 1 group Structural Biology Group TorVergata
	Chapter 7 Implicit Solvent Models in Molecular Dynamics Simulations: A Brief Overview [My Copy] Annual Reports in Computational Chemistry, Vol. 4 (2008), pp. 125-137. by A. Onufriev posted to solvent protein molecular_dynamics by A_Coletta_Thesis on 2009-10-06 11:36:30 as along with 1 person and 1 group flbarroso Structural Biology Group TorVergata
	Chapter 6 Implicit Solvent Simulations of Biomolecules in Cellular Environments [My Copy] Annual Reports in Computational Chemistry, Vol. 4 (2008), pp. 107-121. by M. Feig, S. Tanizaki, M. Sayadi posted to solvent protein molecular_dynamics by A_Coletta_Thesis on 2009-10-06 11:35:24 as along with 2 people and 2 groups flbarroso sobolevnrm Structural Biology Group TorVergata baker-group
	Chapter 9 Applications and Advances of QM/MM Methods in Computational Enzymology [My Copy] Annual Reports in Computational Chemistry, Vol. 4 (2008), pp. 155-169. by A. Lodola, C. Woods, A. Mulholland posted to protein dft ab-initio by A_Coletta_Thesis on 2009-10-06 11:32:55 as along with 1 group Structural Biology Group TorVergata
	Chapter 4 Modeling Protein–Protein and Protein–Nucleic Acid Interactions: Structure, Thermodynamics, and Kinetics [My Copy] Annual Reports in Computational Chemistry, Vol. 4 (2008), pp. 67-87. by H. Zhou, S. Qin, H. Tjong posted to protein molecular_dynamics modeling dna by A_Coletta_Thesis on 2009-10-06 11:31:19 as along with 1 person and 2 groups sobolevnrm Structural Biology Group TorVergata baker-group
	Computation of protein p K’s values by an integrated density functional theory/Polarizable Continuum Model approach [My Copy] Theoretical Chemistry Accounts: Theory, Computation, and Modeling (Theoretica Chimica Acta), Vol. 111, No. 2. (17 March 2004), pp. 237-245. by Vincenzo Barone, Roberto Improta, Nadia Rega posted to protein poisson_boltzman pk electrostatic by A_Coletta_Thesis on 2009-09-07 14:48:59 as along with 1 group Structural Biology Group TorVergata
	Mesoscopic model for mechanical characterization of biological protein materials [My Copy] Journal of Computational Chemistry, Vol. 30, No. 6. (2009), pp. 873-880. by Gwonchan Yoon, Hyeong-Jin Park, Sungsoo Na, Kilho Eom posted to modeling molecular_dynamics protein by A_Coletta_Thesis on 2009-03-16 10:49:26 as along with 1 group Structural Biology Group TorVergata
	Performance of density functional models to reproduce observed <SUP><FONT SIZE='-1'>13</FONT></SUP>C<SUP><FONT SIZE='-1'>alpha</FONT></SUP> chemical shifts of proteins in solution [My Copy] Journal of Computational Chemistry, Vol. 30, No. 6. (2009), pp. 884-892. by Jorge A. Vila, Héctor A. Baldoni, Harold A. Scheraga posted to ab-initio nmr protein by A_Coletta_Thesis on 2009-03-16 10:48:55 as along with 1 group Structural Biology Group TorVergata
	A multipole-based water potential with implicit polarization for biomolecular simulations [My Copy] Journal of Computational Chemistry, Vol. 9999, No. 9999. (2008), NA. by T. R. Walsh, T. Liang posted to force_field parametrization protein water by A_Coletta_Thesis on 2009-03-16 10:48:38 as along with 1 person and 1 group middledomain Structural Biology Group TorVergata
	SHARPEN-Systematic Hierarchical Algorithms for Rotamers and Proteins on an Extended Network. [My Copy] Journal of computational chemistry (23 January 2009) by Ilya V V. Loksha, James R R. Maiolo, Cheng W W. Hong, Albert Ng, Christopher D D. Snow posted to modeling protein by A_Coletta_Thesis on 2009-03-16 10:47:51 as along with 3 people and 3 groups apaydin sobolevnrm barry baker-group Structural Biology Group TorVergata structural_bioinformatics
	GolP: An atomistic force-field to describe the interaction of proteins with Au(111) surfaces in water [My Copy] Journal of Computational Chemistry, Vol. 9999, No. 9999. (2008), NA. by F. Iori, R. Di Felice, E. Molinari, S. Corni posted to ab-initio force_field parametrization protein surface by A_Coletta_Thesis on 2009-02-06 13:45:21 as along with 1 group Structural Biology Group TorVergata
	Calculations of protein circular dichroism from first principles [My Copy] Chirality, Vol. 16, No. 4. (2004), pp. 234-243. by David M. Rogers, Jonathan D. Hirst posted to ab-initio cd protein spectra by A_Coletta_Thesis on 2009-01-22 19:13:33 as along with 1 person and 1 group oteri Structural Biology Group TorVergata
	First-principles calculations of protein circular dichroism in the far-ultraviolet and beyond [My Copy] Chirality, Vol. 18, No. 5. (2006), pp. 340-347. by Mark T. Oakley, Benjamin M. Bulheller, Jonathan D. Hirst posted to ab-initio cd protein spectra by A_Coletta_Thesis on 2009-01-22 19:12:33 as along with 2 people and 1 group loison oteri Structural Biology Group TorVergata

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topoisomerase	106
molecular_dynamics	104
ab-initio	89
camptothecin	52
parametrization	50
dft	33
dna	26
topotecan	24
inhibitors	23
abc	22
atp_binding_cassette	22
metadynamics	22
resp	20
force_field	18
modeling	18
spectra	16
td-dft	16
coarse_grained	15
docking	15
nmr	15
structure	15
protein	14
dim	11
indole	11
software	11
free-energy	10
tdp1	10
chemical_shifts	8
chemistry	8
folding	8
pmf	8
review	8
dielectric	7
spectroscopy	7
qsar	6
solvent	6
umbrella-sampling	6
apoptosis	5
frequency	5
giao	5
water	5
cancer	4
computation	4
fluorescence	4
irinotecan	4
isoquinoline	4
monte_carlo	4
neural_networks	4
pcm	4
domain	3
infra_red	3
leishmania	3
single_molecule	3
basis_set	2
binding	2
cd	2
clinical	2
drug_design	2
electrostatic	2
epr	2
gene	2
irreversible	2
modification	2
perturbation_theory	2
pme	2
poisson_boltzman	2
ribosome	2
rna	2
supercoiled_dna	2
supercoiling	2
thermodynamics	2
tumor	2
uv_spectra	2
vaccinia	2
activity	1
algorithm	1
aminoacid	1
anisotropy	1
antechamber	1
antibiotics	1
calorimetric	1
cluster_analysis	1
csgt	1
diffusion	1
dna_binding	1
dna_oligomer	1
dna_supercoiled	1
entropy	1
free_energy	1
genetic_algorithm	1
isocarbostyril	1
langevin	1
lanthanide	1
liouville	1
mitochondria	1
mutants	1
myoglobin	1
narciclasine	1
nucleoside	1
oniom	1
order_parameter	1
peptide	1
pk	1
population_analysis	1
psoralens	1
raman	1
reaction	1
replica_exchange	1
scaling	1
scattering	1
sequence_analysis	1
simulated_annealing	1
surface	1
synthesis	1
tip3p	1
transcription	1
wavelet	1

A_Coletta_Thesis's protein [14 articles] Export

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