
PLS ( Partial Least-Squares )¹æ¹ýÀº Thermo Scientific TQ Analyst ¼ÒÇÁÆ®¿þ¾î¸¦ ÀÌ¿ëÇÏ¿© ÀÌÂ÷ ¹ÌºÐÀÇ CalibrationÀ» À§ÇØ »ç¿ëµÇ¾úÀ¸¸ç, Ç¥ 3¿¡¼ º¸ÀÌ´Â ¹Ù¿Í °°ÀÌ 4,800~7,600cm-1 ±¸°£¿¡¼ MSC ( Multiplicative Signal Correction )À» ÀÌ¿ëÇÏ¿© ºÐ¼®µÇ¾ú´Ù.

PRESS ( The Prediction Residual Error Sum of Squares )´Â º¸Á¤(Calibration)À» Çϱâ À§Çؼ ÇϳªÀÇ Factor·Î »ç¿ëµÇ¾î Á³À¸¸ç, Correlation coefficient ´Â 8.05ÀÇ RMSEC( Root Mean Square Error of Calibration )ÀÇ °ª°ú ÇÔ²² 0.99841ÀÇ °ªÀ» ³ªÅ¸³Â´Ù. Cross-validation ºÐ¼®¿¡¼ 11.4ÀÇ RMSEC °ª°ú ÇÔ²² 0.99692ÀÇ °ªÀ» ³ªÅ¸³Â´Ù.
»õ·Î¿î È¥ÇÕ¹°ÀÌ °³¹ß µÈ Åë°è ¸ðµ¨À» °ËÁõÇϱâ À§Çؼ ¶ÇÇÑ ¾Æ½ºÄں긣»ê(ºñŸ¹ÎC)ÀÇ ºñÀ²À» ¿¹ÃøÇϱâ À§Çؼ »ç¿ëµÇ¾ú´Ù. 8°³ÀÇ »õ·Î¿î »ùÇÃÀÌ ¿ø·¡ÀÇ Calibration¿¡ Àû¿ëµÈ À¯»çÇÑ ¹æ¹ýÀ¸·Î ÁغñµÇ¾úÀ¸¸ç, °°Àº ¹æ¹ýÀ¸·Î ÃøÁ¤ÇÑ °á°ú RMSEP ( Root Mean Standard Error of Prediction )ÀÇ °ªÀ¸·Î 11.2¸¦ ³ªÅ¸³Â´Ù.
Ç¥ 4´Â °³¹ßµÈ Åë°è ¸ðµ¨¿¡ ´ëÇÏ¿© Calibration Standard(o)¿Í Validating test sample(+)ÀÇ Calibration°ú Residual ¿¡ ´ëÇÑ ÇÔÃàÀ» ³ªÅ¸³½ °ÍÀÌ´Ù.


¾Æ½ºÄں긣»ê(ºñŸ¹ÎC)°ú ³ì¸» È¥ÇÕ¹°ÀÇ Á¤È®ÇÑ ºÐ¼®ÀÌ FT-NIRÀ» ÀÌ¿ëÇÏ¿© ¼º°øÀûÀ¸·Î ¼öÇàµÇ¾úÀ¸¸ç, 53 ~500 mg/g ¹üÀ§·Î ³ì¸» ³»ÀÇ ¾Æ½ºÄں긣»ê(ºñŸ¹ÎC)À» Calibration standard·Î »ç¿ëµÇ¾úÀ¸¸ç PLS Åë°è ¸ðµ¨À» °³¹ßÇϱâ À§Çؼ »ç¿ëµÇ¾ú´Ù. Åë°è ¸ðµ¨Àº ¸Å¿ì ³·Àº ¿¡·¯¿Í ³ôÀº Correlation coefficient°ú ÇÔ²² ¿ì¼öÇÑ Åë°è °ªÀ» »êÃâÇØ ³»°í ÀÖ´Ù.
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