ECEPP/3 force field: Difference between revisions

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(New page: '''Empirical Conformational Energy Program for Peptides''' (ECEPP). (See also ECEPP/2). ==References== #[http://dx.doi.org/10.1021/j100194a068 George Nemethy, Kenneth D. Gibson, Kathle...)
 
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{{Stub-general}}
'''Empirical Conformational Energy Program for Peptides''' (ECEPP). (See also [[ECEPP/2]]).
'''Empirical Conformational Energy Program for Peptides''' (ECEPP). (See also [[ECEPP/2]]).
==Functional form==
==Parameters==
==References==
==References==
#[http://dx.doi.org/10.1021/j100194a068 George Nemethy, Kenneth D. Gibson, Kathleen A. Palmer, Chang No. Yoon, Germana Paterlini, Adriana Zagari, Shirley Rumsey, and Harold A. Scheraga "Energy parameters in polypeptides. 10. Improved geometrical parameters and nonbonded interactions for use in the ECEPP/3 algorithm, with application to proline-containing peptides",  The Journal of Physical Chemistry '''96''' pp. 6472 - 6484 (1992)]
#[http://dx.doi.org/10.1021/j100194a068 George Nemethy, Kenneth D. Gibson, Kathleen A. Palmer, Chang No. Yoon, Germana Paterlini, Adriana Zagari, Shirley Rumsey, and Harold A. Scheraga "Energy parameters in polypeptides. 10. Improved geometrical parameters and nonbonded interactions for use in the ECEPP/3 algorithm, with application to proline-containing peptides",  The Journal of Physical Chemistry '''96''' pp. 6472 - 6484 (1992)]
[[category: force fields]]
[[category: force fields]]

Latest revision as of 12:54, 5 March 2010

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Empirical Conformational Energy Program for Peptides (ECEPP). (See also ECEPP/2).

Functional form[edit]

Parameters[edit]

References[edit]

  1. George Nemethy, Kenneth D. Gibson, Kathleen A. Palmer, Chang No. Yoon, Germana Paterlini, Adriana Zagari, Shirley Rumsey, and Harold A. Scheraga "Energy parameters in polypeptides. 10. Improved geometrical parameters and nonbonded interactions for use in the ECEPP/3 algorithm, with application to proline-containing peptides", The Journal of Physical Chemistry 96 pp. 6472 - 6484 (1992)