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A Reliable Docking/Scoring Scheme Based on the Semiempirical Quantum Mechanical PM6-DH2 Method Accurately Covering Dispersion and H-Bonding: HIV-1 Protease with 22 Ligands

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author: Pavel Hobza  Jan Řezáč  Jan Konvalinka  Jindrich Fanfrlík 

Publication date October 1, 2010
Language English
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