A New Soft-Core Potential Function for Molecular Dynamics Applied to the Prediction of Protein Loop Conformations

Journal of Computational Chemistry

Volumn 21, Issue 5, 2000, Pages 388-397

  Tappura, K ^a   Lahtela Kakkonen, M ^b   Teleman, O ^a,b,c  

^a VTT TECHNICAL RESEARCH CENTRE OF FINLAND   (Finland)

^b CSC Scientific Computing Ltd   (Finland)

^c INNVENTIA AB   (Sweden)

Author keywords

Molecular dynamics; New soft core potential; Prediction of protein loop structures; Protein loop simulation with explicit water; Sampling of the conformational space

Indexed keywords

EID: 0001213834     PISSN: 01928651     EISSN: None     Source Type: Journal    
DOI: 10.1002/(SICI)1096-987X(20000415)21:5<388::AID-JCC5>3.0.CO;2-M     Document Type: Article

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