Cover Image, Volume 35, Issue 19.
- Published in:
- Journal of Computational Chemistry, 2014, v. 35, n. 19, p. iii, doi. 10.1002/jcc.23521
- Publication type:
- Article
Works matching IS 01928651 AND DT 2014 AND VI 35 AND IP 19
Results: 10
1
2
Cover Image, Volume 35, Issue 19.
- Published in:
- 2014
- Publication type:
- Other
3
Reaction mechanism of Ru(II) piano-stool complexes: Umbrella sampling QM/MM MD study.
- Published in:
- Journal of Computational Chemistry, 2014, v. 35, n. 19, p. 1446, doi. 10.1002/jcc.23639
- By:
- Publication type:
- Article
4
A Molecular modeling study of the changes of some steric properties of the precatalysts during the olefin metathesis reaction.
- Published in:
- Journal of Computational Chemistry, 2014, v. 35, n. 19, p. 1457, doi. 10.1002/jcc.23641
- By:
- Publication type:
- Article
5
Cover Image, Volume 35, Issue 19.
- Published in:
- 2014
- Publication type:
- Other
6
Transformation between α-helix and β-sheet structures of one and two polyglutamine peptides in explicit water molecules by replica-exchange molecular dynamics simulations.
- Published in:
- Journal of Computational Chemistry, 2014, v. 35, n. 19, p. 1430, doi. 10.1002/jcc.23633
- By:
- Publication type:
- Article
7
Modeling the electrostatic potential of asymmetric lipopolysaccharide membranes: The MEMPOT algorithm implemented in DelPhi.
- Published in:
- Journal of Computational Chemistry, 2014, v. 35, n. 19, p. 1418, doi. 10.1002/jcc.23632
- By:
- Publication type:
- Article
8
Efficient parameterization of torsional terms for force fields.
- Published in:
- Journal of Computational Chemistry, 2014, v. 35, n. 19, p. 1438, doi. 10.1002/jcc.23636
- By:
- Publication type:
- Article
9
Simulations of remote mutants of dihydrofolate reductase reveal the nature of a network of residues coupled to hydride transfer.
- Published in:
- Journal of Computational Chemistry, 2014, v. 35, n. 19, p. 1411, doi. 10.1002/jcc.23629
- By:
- Publication type:
- Article
10
A comparison of low and high activity precatalysts: Do the calculated energy barriers during the self-metathesis reaction of 1-Octene correlate with the precatalyst metathesis activity?
- Published in:
- Journal of Computational Chemistry, 2014, v. 35, n. 19, p. 1464, doi. 10.1002/jcc.23642
- By:
- Publication type:
- Article