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    JCC
    2006
    67views more  JCC 2006»
    Heuristic molecular lipophilicity potential (HMLP): Lipophilicity and hydrophilicity of amino acid side chains
    13 years 5 months ago
    Heuristic molecular lipophilicity potential (HMLP): Lipophilicity and hydrophilicity of amino acid side chains
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    : Heuristic molecular lipophilicity potential (HMLP) is applied in the study of lipophilicity and hydrphilcity of 20 natural amino acids side chains. The HMLP parameters, surface a...
    Qishi Du, Da-Peng Li, Wen-Zhang He, Kuo-Chen Chou
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    JCC
    2006
    59views more  JCC 2006»
    Comparison of implicit solvent models for the simulation of protein-surface interactions
    13 years 5 months ago
    Comparison of implicit solvent models for the simulation of protein-surface interactions
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    Abstract: Empirical force field-based molecular simulations can provide valuable atomistic-level insights into protein
    Yu Sun, Robert A. Latour
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    JCC
    2006
    57views more  JCC 2006»
    A search algorithm for fixed-composition protein design
    13 years 5 months ago
    A search algorithm for fixed-composition protein design
    Download  www.mayo.caltech.edu
    : We present a computational protein design algorithm for finding low-energy sequences of fixed amino acid composition. The search algorithms used in protein design typically do no...
    Geoffrey K. Hom, Stephen L. Mayo
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    JCC
    2006
    47views more  JCC 2006»
    On the O2 binding of Fe-porphyrin, Fe-porphycene, and Fe-corrphycene complexes
    13 years 5 months ago
    On the O2 binding of Fe-porphyrin, Fe-porphycene, and Fe-corrphycene complexes
    Download  www.qcri.or.jp
    : Based on our previous study for the O2 binding of the Fe
    Hiroyuki Nakashima, Jun-Ya Hasegawa, Hiroshi Nakat...
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