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His research revolves around excited electronic states and their real-time dynamics in various materials using accurate computational methods and making use of modern super computers.
The design and application of the quantitatively accurate computational methods is discussed.
We emphasize design rationale, including examples, and also demonstrate the importance of using highly accurate computational methods in molecular design.
Therefore we investigate the molecular transport along the main mitochondrial axis using highly accurate computational methods.
The development of accurate computational methods for protein function prediction can therefore aid in reducing the gap between the speed of whole-genome sequencing and the functional annotation of their encoded proteomes.
Therefore, it is important to predict gene-HPO term associations using accurate computational methods.
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Since experimental methods to determine the interaction specificity of the PDZ domains are expensive and labor intensive, an accurate computational method is thus needed.
However, when the analysis is carried out on large scale systems, it becomes imperative to employ a highly accurate computational method in order to obtain reliable values.
An accurate computational method based on the boundary integral formulation is presented for solving boundary value problems for Stokes and Darcy flows.
Thus, for the smart composite beams which consist of a laminated composite base beam and PZT layers, it is very important to develop a very reliable mathematical model and to use a very accurate computational method to predict accurate dynamic characteristics at very high ultrasonic frequency.
We present an efficient and accurate computational method for predicting three dimensional unsteady flows in multistage turbomachinery.
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