Some Recent Developments in Computational Chemistry.
- Published in:
- Molecular Simulation, 1996, v. 16, n. 1-3, p. 193, doi. 10.1080/08927029608024072
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- Publication type:
- Article
Works in Molecular Simulation, 1996, Vol 16, Issue 1-3
Results: 18
1
2
Mechanism of the Atomic Intermixing Process in Crystalline Microclusters.
- Published in:
- Molecular Simulation, 1996, v. 16, n. 1-3, p. 179, doi. 10.1080/08927029608024071
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- Publication type:
- Article
3
How does the Electrostatic Force Cut-Off Generate Non-uniform Temperature Distributions in Proteins?
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- Molecular Simulation, 1996, v. 16, n. 1-3, p. 167, doi. 10.1080/08927029608024070
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- Publication type:
- Article
4
Rearrangement of the Hydrogen-Bonded Network of the Clathrate Hydrates Encaging Polar Guest.
- Published in:
- Molecular Simulation, 1996, v. 16, n. 1-3, p. 151, doi. 10.1080/08927029608024069
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- Publication type:
- Article
5
Non Equilibrium Molecular Dynamics Simulation of Coupled Heat- and Mass Transport Across a Liquid/Vapor Interface.
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- Molecular Simulation, 1996, v. 16, n. 1-3, p. 139, doi. 10.1080/08927029608024068
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- Publication type:
- Article
6
Liquid-Like Behavior in Solids.
- Published in:
- Molecular Simulation, 1996, v. 16, n. 1-3, p. 127, doi. 10.1080/08927029608024067
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- Publication type:
- Article
7
Computer Simulation of Vapor-Liquid Phase Separation.
- Published in:
- Molecular Simulation, 1996, v. 16, n. 1-3, p. 119, doi. 10.1080/08927029608024066
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- Publication type:
- Article
8
A Quantum Dynamics Simulation of Molecular Vibrations by the Pechukas Method.
- Published in:
- Molecular Simulation, 1996, v. 16, n. 1-3, p. 107, doi. 10.1080/08927029608024065
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- Publication type:
- Article
9
Investigations of Nematic-Isotropic Transition by Means of Constant Pressure Molecular Dynamics Simulations.
- Published in:
- Molecular Simulation, 1996, v. 16, n. 1-3, p. 99, doi. 10.1080/08927029608024064
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- Publication type:
- Article
10
Potential Surface Analysis and Low Temperature Dynamics of Water.
- Published in:
- Molecular Simulation, 1996, v. 16, n. 1-3, p. 87, doi. 10.1080/08927029608024063
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- Publication type:
- Article
11
Molecular Dynamics/Free Energy Perturbation Studies of the Thermostable V74I Mutant of Ribonuclease HI.
- Published in:
- Molecular Simulation, 1996, v. 16, n. 1-3, p. 75, doi. 10.1080/08927029608024062
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- Publication type:
- Article
12
Dynamics of Small Molecules in a Dense Polymer Matrix: Molecular Dynamics Studies.
- Published in:
- Molecular Simulation, 1996, v. 16, n. 1-3, p. 59, doi. 10.1080/08927029608024061
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- Publication type:
- Article
13
Computer Simulations of Phase Separations in Surfactant Solutions.
- Published in:
- Molecular Simulation, 1996, v. 16, n. 1-3, p. 47, doi. 10.1080/08927029608024060
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- Publication type:
- Article
14
Ab Initio Molecular Dynamics for Simple Liquid Metals Based on the Hypernetted-Chain Approximation.
- Published in:
- Molecular Simulation, 1996, v. 16, n. 1-3, p. 31, doi. 10.1080/08927029608024059
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- Publication type:
- Article
15
Molecular Dynamics Studies of Electrolyte Solution/Metal Interfaces.
- Published in:
- Molecular Simulation, 1996, v. 16, n. 1-3, p. 19, doi. 10.1080/08927029608024058
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- Publication type:
- Article
16
The Free Energy Profiles for the Electron Transfer Reactions Calculated from the Integral Equation Method of Liquids.
- Published in:
- Molecular Simulation, 1996, v. 16, n. 1-3, p. 3, doi. 10.1080/08927029608024057
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- Publication type:
- Article
17
Guest Editorial.
- Published in:
- 1996
- By:
- Publication type:
- Editorial
18
Editorial board page for “Molecular Simulation”, Volume 16, Number 1-3.
- Published in:
- 1996
- Publication type:
- Editorial