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    JCC
    1998
    46views more  JCC 1998»
    Electrostatic model for infrared intensities in a spectroscopically determined molecular mechanics force field
    15 years 1 months ago
    Electrostatic model for infrared intensities in a spectroscopically determined molecular mechanics force field
    Download  deepblue.lib.umich.edu
    Kim Palmö, Samuel Krimm
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    JCC
    1998
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    Performance of parallel TURBOMOLE for density functional calculations
    15 years 1 months ago
    Performance of parallel TURBOMOLE for density functional calculations
    Download  www.public.iastate.edu
    Malte Von Arnim, Reinhart Ahlrichs
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    JCC
    1998
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    Approach to regiochemistry using local softness in 1, 3-dipolar cycloadditions
    15 years 1 months ago
    Approach to regiochemistry using local softness in 1, 3-dipolar cycloadditions
    Download  www.quantchem.kuleuven.ac.be
    Asit K. Chandra, Minh Tho Nguyen
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    JCC
    1998
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    Optimizing efficiency of perturbative Monte Carlo method
    15 years 1 months ago
    Optimizing efficiency of perturbative Monte Carlo method
    Download  truong.hec.utah.edu
    Tom J. Evans, Thanh N. Truong
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    68
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    JCC
    1998
    59views more  JCC 1998»
    Calculation of solvation free energy using RISM theory for peptide in salt solution
    15 years 1 months ago
    Calculation of solvation free energy using RISM theory for peptide in salt solution
    Download  www.jcbi.ru
    Masahiro Kinoshita, Yuko Okamoto, Fumio Hirata
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