Molecular dynamics simulations of structural changes during procaspase 3 activation
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The novel fast-growth or multiple steering mol. dynamics (MSMD) technique has been recently developed by Jarzynski to calc. free energy profiles along general transformation pathways (Phys. Rev. Lett. 1997, 78, 2690-2693; Phys. Rev. E 1997, 56, 5018-5035). ...
We present the resitivity and structural studies of the melt-spun Al-Mn alloys (with 10-18 at% Mn) that contain more than 50 vol% of the quasicrystalline (qX) Al//4Mn phase. The resistivity varies little with temperature up to approximately 600 K where it ...
The dielectric behavior and structure of the Sr(Zn1/3Nb2/3)O3-Ba(Zn1/3Nb2/3)O3 solid solution have been investigated with the intention of understanding the relationship between the structural changes and the temperature coefficient of the relative permitt ...
This paper presents results of our research that targets the improvement of workgroup efficiency with technological support for the management of group-related information. We built a software tool that enables all the people in a workgroup to work with in ...
We study the problem of finding a characterization for the channel that results when a queue is operated under multiple access conditions. In such systems, the mechanism by which different sources gain access to the channel plays a fundamental role in defi ...
The present paper describes the challenges posed by transposing a successful conventional course into an – hopefully – equally successful web-based course, with the name i-Structures. This work is under way as part of the Swiss Virtual Campus project. The ...
4th International Conference on New Educational Environments2002
This paper presents results of our research that targets the improvement of workgroup efficiency with technological support for the management of group-related information. We built a software tool that enables all the people in a workgroup to work with in ...
We investigate by first-principles molecular dynamics the structural properties of liquid GeSe4, i.e., GexSe1-x at x = 0.2. This composition is very close to the so-called stiffness threshold composition, at which dramatic changes in a series of experiment ...