Computer-Assisted Chemical Analysis

这项研究是在一般领域的分析和表面 化学和基于计算机的研究领域。这 研究涉及多个相互关联的研究领域 其将联合收割机分离和光谱检测相结合， 用于复杂有机物分析的协同方法 混合物。本研究的总体目标是开发新的 综合混合物分析指南和算法 软件/硬件系统比那些 目前正在使用。 这项研究包括化学分析的许多领域 包括色谱法、红外光谱法、核 磁共振和质谱。使用这些 这些技术的结合应该提供独特的能力 用于未知成分样品的分析测量。

This research is in the general area of analytical and surface chemistry and in the subfield of computer based research. This research involves a number of inter-related research areas which combine separation and spectroscopic detection to produce synergistic methods for the analysis of complex organic mixtures. The overall goal of this research is to develop novel guidelines and algorithms for integrated mixture analysis using software/hardware systems more capable than those that are currently in use. This research encompasses many areas of chemical analysis including chromatography, infrared spectrometry, nuclear magnetic resonance and mass spectrometry. The use of these techniques in combination should provide unique capabilities for analytical measurement of samples with unknown compositions.