Accuracy assessment of semiempirical molecular electrostatic potential of proteins

Theoretical Chemistry Accounts

Volumn 109, Issue 4, 2003, Pages 213-219

  Anisimov, Victor M ^a   Anikin, Nikolay ^b   Bugaenko, Vladislav ^b   Bobrikov, Vladimir ^b   Andreyev, Alexey ^b  

^a FQS Poland   (Poland)

^b Quantum Biochemistry Group   (Russian Federation)

Author keywords

Biomolecules; Coulomb potential; Dipole moment; Electrostatic maps; Semiempirical method

Indexed keywords

AMINO ACID;

ARTICLE; CALCULATION; EMPIRICISM; MOLECULAR DYNAMICS; MOLECULAR MODEL; PROTEIN ANALYSIS;

EID: 0038481636     PISSN: 1432881X     EISSN: None     Source Type: Journal    
DOI: 10.1007/s00214-002-0400-8     Document Type: Article

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