Works matching AU Aparoy, P.
Results: 2
Minimum MD simulation length required to achieve reliable results in free energy perturbation calculations: Case study of relative binding free energies of fructose-1,6-bisphosphatase inhibitors.
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- Journal of Computational Chemistry, 2011, v. 32, n. 10, p. 2097, doi. 10.1002/jcc.21791
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- Article
Homology modeling of 5-lipoxygenase and hints for better inhibitor design.
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- Journal of Computer-Aided Molecular Design, 2008, v. 22, n. 9, p. 611, doi. 10.1007/s10822-008-9180-0
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- Article