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Volume 11; Issue 6
Main
Journal of Molecular Modeling
Volume 11; Issue 6
Journal of Molecular Modeling
Volume 11; Issue 6
1
Molecular modeling of phosphorylation sites in proteins using a database of local structure segments
Dariusz Plewczynski
,
Lukasz Jaroszewski
,
Adam Godzik
,
Andrzej Kloczkowski
,
Leszek Rychlewski
Journal:
Journal of Molecular Modeling
Year:
2005
Language:
english
File:
PDF, 385 KB
Your tags:
english, 2005
2
AM1* parameters for aluminum, silicon, titanium and zirconium
Paul Winget
,
Timothy Clark
Journal:
Journal of Molecular Modeling
Year:
2005
Language:
english
File:
PDF, 3.74 MB
Your tags:
english, 2005
3
Hierarchic system of QSAR models (1D–4D) on the base of simplex representation of molecular structure
Victor E. Kuz’min
,
Anatoly G. Artemenko
,
Pavel G. Polischuk
,
Eugene N. Muratov
,
Alexander I. Hromov
,
Anatoly V. Liahovskiy
,
Sergey A. Andronati
,
Svetlana Yu. Makan
Journal:
Journal of Molecular Modeling
Year:
2005
Language:
english
File:
PDF, 595 KB
Your tags:
english, 2005
4
Predicted consequences of site-directed mutagenesis and the impact of species variation on prion protein misfolding through the N-terminal domain
David P Molloy
,
Beining Chen
Journal:
Journal of Molecular Modeling
Year:
2005
Language:
english
File:
PDF, 385 KB
Your tags:
english, 2005
5
H-bonded complexes between acetylacetone and two molecules of methanol: HF and DFT level study
Vassil B Delchev
,
Hans Mikosch
Journal:
Journal of Molecular Modeling
Year:
2005
Language:
english
File:
PDF, 302 KB
Your tags:
english, 2005
6
Structure prediction of a multi-domain EF-hand Ca2+binding protein by PROPAINOR
Subramanian Jyothi
,
Sourajit M. Mustafi
,
Kandala V. R. Chary
,
Rajani R. Joshi
Journal:
Journal of Molecular Modeling
Year:
2005
Language:
english
File:
PDF, 463 KB
Your tags:
english, 2005
7
Comparative analysis of different competitive antagonists interaction with NR2A and NR2B subunits ofN-methyl-D-aspartate (NMDA) ionotropic glutamate receptor
Mathias-Costa Blaise
,
Ramanathan Sowdhamini
,
Nithyananda Pradhan
Journal:
Journal of Molecular Modeling
Year:
2005
Language:
english
File:
PDF, 866 KB
Your tags:
english, 2005
8
Computational study of a transition state analog of phosphoryl transfer in the Ras–RasGAP complex: AlFxversus MgF3–
Bella L. Grigorenko
,
Alexander V. Nemukhin
,
Raul E. Cachau
,
Igor A. Topol
,
Stanley K. Burt
Journal:
Journal of Molecular Modeling
Year:
2005
Language:
english
File:
PDF, 379 KB
Your tags:
english, 2005
9
Study of a ligand complexed with Cdk2/Cdk4 by computer simulation
Yongjun Jiang
,
Jianwei Zou
,
Chunshan Gui
Journal:
Journal of Molecular Modeling
Year:
2005
Language:
english
File:
PDF, 465 KB
Your tags:
english, 2005
10
Exploring 3D-QSAR of thiazole and thiadiazole derivatives as potent and selective human adenosine A3receptor antagonists+
Prosenjit Bhattacharya
,
J. Thomas Leonard
,
Kunal Roy
Journal:
Journal of Molecular Modeling
Year:
2005
Language:
english
File:
PDF, 341 KB
Your tags:
english, 2005
11
Topochemical models for prediction of cyclin-dependent kinase 2 inhibitory activity of indole-2-ones
Harish Dureja
,
Anil Kumar Madan
Journal:
Journal of Molecular Modeling
Year:
2005
Language:
english
File:
PDF, 275 KB
Your tags:
english, 2005
12
A global resource for computational chemistry
Peter Murray-Rust
,
Henry S. Rzepa
,
James J. P. Stewart
,
Yong Zhang
Journal:
Journal of Molecular Modeling
Year:
2005
Language:
english
File:
PDF, 333 KB
Your tags:
english, 2005
13
Infrared and Raman spectra and vibrational analyses calculated with Moeller–Plesset perturbation theory of second order of nitrosoethylene and its chloro-derivatives
Wolfgang Förner
,
Hassan M. Badawi
Journal:
Journal of Molecular Modeling
Year:
2005
Language:
english
File:
PDF, 366 KB
Your tags:
english, 2005
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