Structure-based redesign of proteins for minimal T-cell epitope content.
- Published in:
- Journal of Computational Chemistry, 2013, v. 34, n. 10, p. 879, doi. 10.1002/jcc.23213
- By:
- Publication type:
- Article
Works matching IS 01928651 AND DT 2013 AND VI 34 AND IP 10
Results: 11
1
2
Inside Cover, Volume 34, Issue 10.
- Published in:
- Journal of Computational Chemistry, 2013, v. 34, n. 10, p. iii, doi. 10.1002/jcc.23275
- Publication type:
- Article
3
Spectroscopic fingerprints of toroidal nuclear quantum delocalization via Ab Initio path integral simulations.
- Published in:
- Journal of Computational Chemistry, 2013, v. 34, n. 10, p. 827, doi. 10.1002/jcc.23206
- By:
- Publication type:
- Article
4
Acceleration of coarse grain molecular dynamics on GPU architectures.
- Published in:
- Journal of Computational Chemistry, 2013, v. 34, n. 10, p. 803, doi. 10.1002/jcc.23183
- By:
- Publication type:
- Article
5
Assessment of density functional methods for reaction energetics: Iridium-catalyzed water oxidation as case study.
- Published in:
- Journal of Computational Chemistry, 2013, v. 34, n. 10, p. 870, doi. 10.1002/jcc.23212
- By:
- Publication type:
- Article
6
Cover Image, Volume 34, Issue 10.
- Published in:
- Journal of Computational Chemistry, 2013, v. 34, n. 10, p. i, doi. 10.1002/jcc.23274
- Publication type:
- Article
7
Calculation of wave-functions with frozen orbitals in mixed quantum mechanics/molecular mechanics methods. II. Application of the local basis equation.
- Published in:
- Journal of Computational Chemistry, 2013, v. 34, n. 10, p. 862, doi. 10.1002/jcc.23209
- By:
- Publication type:
- Article
8
On the performance of long-range-corrected density functional theory and reduced-size polarized LPol-n basis sets in computations of electric dipole (hyper)polarizabilities of π-conjugated molecules.
- Published in:
- Journal of Computational Chemistry, 2013, v. 34, n. 10, p. 819, doi. 10.1002/jcc.23197
- By:
- Publication type:
- Article
9
A numerically stable restrained electrostatic potential charge fitting method.
- Published in:
- Journal of Computational Chemistry, 2013, v. 34, n. 10, p. 847, doi. 10.1002/jcc.23208
- By:
- Publication type:
- Article
10
Calculation of wave-functions with frozen orbitals in mixed quantum mechanics/molecular mechanics methods. Part I. Application of the Huzinaga equation.
- Published in:
- Journal of Computational Chemistry, 2013, v. 34, n. 10, p. 854, doi. 10.1002/jcc.23210
- By:
- Publication type:
- Article
11
Simulating GTP:Mg and GDP:Mg with a simple force field: A structural and thermodynamic analysis.
- Published in:
- Journal of Computational Chemistry, 2013, v. 34, n. 10, p. 836, doi. 10.1002/jcc.23207
- By:
- Publication type:
- Article