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integy moment  MHBP  MHPho  hydrogen-bonding potentials  ÄÄλ´óÏÀ°ïæ·­ÒëÒ»ÏÂѽ~~~~~~~~~~~~

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supergreen(½ð±Ò+1): 2010-11-16 22:19:34
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bongb

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supergreen(½ð±Ò+4, ·­ÒëEPI+1):лл£¡ÒªÊDz鵽integy momentµÄ¾ßÌåÒâ˼»¹Íû¸æËßÎÒÒ»ÏÂѽ~ÒòΪҪ¾ßÌå·­Òë °¥ лÀ²Ð»À²^_^ 2010-11-16 22:17:05
integy moment  Ó¦¸ÃÊÇ·­Òë³ÉijÖ־أ¬¾ßÌå²»´óÇå³þ
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The "integy moment" (19-26) is defined in analogy to the dipole moment and describes the distance of the center of mass to the barycenter of polar interaction sites at a given energy level. The higher the integy moment, the clearer is the separation between polar and hydrophobic interaction sites; the lower the integy moment, the closer are the center of the molecule and the barycenter of polar moieties. This could be due either to polar moieties close to the center of mass or at opposite ends of the molecule.

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Molecular hydrogen-bonding potentials
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hydrogen-bonding potentials
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MHPho ²»´óÇå³þ
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supergreen

ľ³æ (СÓÐÃûÆø)


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Originally posted by cfk580713 at 2010-11-16 21:39:58:
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4Â¥2010-11-16 22:19:19
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