Molecular integrity

Tuckerman M E and Hughes A 1998 Path integral molecular dynamics a computational approach to quantum statistical mechanics Classical and Quantum Dynamics In Condensed Phase Simulations ed B J Berne, G Ciccotti and D F Coker (Singapore World Scientific) pp 311-57... 

Martyna, G.J. Adiabatic path integral molecular dynamics methods. I. Theory. J. Chem. Phys. 104 (1996) 2018-2027. 

Rzhetsky A, lossifov I, Koike T, Krauthammer M, Kra P, Morris M, et al. Gene-Ways a system for extracting, analyzing, visualizing, and integrating molecular pathway data. J Biomed Inform 2004 37 43-53. 

Cohen, J.P. and Schweighardt, F.K., Fueling nozzle with integral molecular leak sensor, U.S. patent Application, April 2006. 

It is amazing that these integrated molecular systems undergo information transduction by intermolecular conformation transfer but not by electron transfer. The receptor molecule induces the conformation change of an adjacent molecule when it recognizes the corresponding molecule. Individual molecules in the integrated molecular systems are assembled in such a manner as the conformation of each molecule is coordinated. This is the distinctive characteristics which Eire hardly mimicked by the synthetic molecular systems. 

In contrast to the information transduction mechanism based on conformational change, the information transduction may effectively be performed through the electron transfer if the integrated molecular systems are composed of electronically active molecules. 

Fig. 4 Integrated molecular systems for information transduction through intermolecular electron transfer and conformation change...

Protein Assembling Technology for Integrated Molecular Systems... 

Shao N, Lu S, Wickstrom E, Panchapakesan B (2007) Integrated molecular targeting of IGF1R and HER2 surface receptors and destruction of breast cancer cells using single wall carbon nanotubes. Nanotechnology 18 Art. No. 315101. 

Figure 8. Weight differential and integral molecular weight distribution plots.

IMAGE (Integrated Molecular Analysis of Genomes and Their Expression) consortium collection (http //image.llnl.gov/image/html/idistributors. shtml). The current U.S. distributors are ... 

The microarray comprised 9600 nonredundant ESTs from the integrated molecular analysis of genomes and their expression (IMAGE) collection of human cDNA clones arrayed onto nylon membranes. Of these, 1875 clones (19.5%) were verified by resequencing 110 of the 589 genes expressed (18.7%) that correlated with the metastatic potential were among those verified by sequencing. 

Stahl, M., Cuba, W. and Kansy, M. (2006) Integrating molecular design resources within modern drug discovery research the Roche experience. Drug Discovery Today, 11, 326-333. 

Figure 6.6 (a) Dihydrogen-bonded complex system NH4+- H-Be-H represented by the optimized equilibrium geometry, and (b) the ab initio path integral molecular dynamics simulation (representative snapshot of configuration). (Reproduced with permission from ref. 12.)... 

The integrated molecular replacement method comparison of automatic protocols... 

Figure 7.3 General flow chart for an Integrated molecular replacement structure solution protocol.

Department of Integrative Molecular Neuroscience, Division of Neuroscience eh Psychological Medicine, Imperial College Yaculty of Medicine, Charing Cross Hospital,... 

Lauffenburger DA, Horwitz AF (1996) Cell migration a physically integrated molecular process. Cell 84 359-369... 

The formation of dynamic artificial supramolecular nanoscale assemblies within living cells will be of interest to find out its influence on cell behaviour since it will integrate molecular self-assembly with biochemical reactions, giving rise to better understanding of biological processes and possible new approaches to tackle diseased states. 

In the case of DNA, Troisi and Orlandi [26] have completed an integrated molecular dynamics/electronic structure study that examines precisely the issue of the dependence of the matrix element on geometry. These investigators studied a ten-base-pair double helical strand, whose interior contained two GC base pairs separated by four AT base pairs. They placed... 

At any i, CRi is, of course, a weight fraction concentration of solute based on or referenced to the concentration of the plateau region. When considered as a weight fraction concentration, CRi will be denoted as W. A plot of Wi versus s is the integral molecular weight distribution for a sample. 

Figure 7. A plot of the integral molecular weight distribution for the poly(l-amidoethylene) standard.

ONIOM Our own n-layered integrated molecular orbital molecular mechanics... 

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