Mechanism of CDK5 activation revealed by steered molecular dynamics simulations and energy calculations.
- Published in:
- Journal of Molecular Modeling, 2010, v. 16, n. 6, p. 1159, doi. 10.1007/s00894-009-0629-4
- By:
- Publication type:
- Article
Works matching IS 16102940 AND DT 2010 AND VI 16 AND IP 6
Results: 11
1
2
Molecular docking and 3D-QSAR studies on triazolinone and pyridazinone, non-nucleoside inhibitor of HIV-1 reverse transcriptase.
- Published in:
- Journal of Molecular Modeling, 2010, v. 16, n. 6, p. 1169, doi. 10.1007/s00894-009-0625-8
- By:
- Publication type:
- Article
3
Histamine (re)uptake by astrocytes: an experimental and computational study.
- Published in:
- Journal of Molecular Modeling, 2010, v. 16, n. 6, p. 1151, doi. 10.1007/s00894-009-0624-9
- By:
- Publication type:
- Article
4
Generation of soluble oligomeric β-amyloid species via copper catalyzed oxidation with implications for Alzheimer’s disease: A DFT study.
- Published in:
- Journal of Molecular Modeling, 2010, v. 16, n. 6, p. 1103, doi. 10.1007/s00894-009-0619-6
- By:
- Publication type:
- Article
5
Molecular modeling of dissociative and non-dissociative chemisorption of nitrosamine on close-ended and open-ended pristine and Stone-Wales defective (5,5) armchair single-walled carbon nanotubes.
- Published in:
- Journal of Molecular Modeling, 2010, v. 16, n. 6, p. 1127, doi. 10.1007/s00894-009-0622-y
- By:
- Publication type:
- Article
6
Homology modeling of Mycobacterium tuberculosis 2C-methyl-d-erythritol-4-phosphate cytidylyltransferase, the third enzyme in the MEP pathway for isoprenoid biosynthesis.
- Published in:
- Journal of Molecular Modeling, 2010, v. 16, n. 6, p. 1061, doi. 10.1007/s00894-009-0615-x
- By:
- Publication type:
- Article
7
Are density functional theory predictions of the Raman spectra accurate enough to distinguish conformational transitions during amyloid formation?
- Published in:
- Journal of Molecular Modeling, 2010, v. 16, n. 6, p. 1093, doi. 10.1007/s00894-009-0610-2
- By:
- Publication type:
- Article
8
AM1* parameters for manganese and iron.
- Published in:
- Journal of Molecular Modeling, 2010, v. 16, n. 6, p. 1109, doi. 10.1007/s00894-009-0614-y
- By:
- Publication type:
- Article
9
Theoretical studies on pyrimidine substituent derivatives as dual inhibitors of AP-1 and NF-κB.
- Published in:
- Journal of Molecular Modeling, 2010, v. 16, n. 6, p. 1139, doi. 10.1007/s00894-009-0609-8
- By:
- Publication type:
- Article
10
Calculations of the charge distribution in dodecyltrimethylammonium: a quantum chemical investigation.
- Published in:
- Journal of Molecular Modeling, 2010, v. 16, n. 6, p. 1085, doi. 10.1007/s00894-009-0620-0
- By:
- Publication type:
- Article
11
Theoretical insights into the trends in molecular properties of HCY, HSiY and HGeY molecules where Y = N, P, As.
- Published in:
- Journal of Molecular Modeling, 2010, v. 16, n. 6, p. 1075, doi. 10.1007/s00894-009-0600-4
- By:
- Publication type:
- Article