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Input to the conformational program

Line form 1 Pront page text AMESS [Pg.169]

Any message to be printed on the title page of the output. Columns 1-72 may contain any valid EBCDIC character. May be blank but a line must be present. [Pg.169]

Line form 2 Global control parameters PORMAT (1012, P10.3) [Pg.169]

1 - 2 KJELD specify the choice of functions. Por usage of potential parameters energy KJELD [Pg.169]

5 - 6 NBTYP specifies the form of tials. non-bonded poten- [Pg.169]


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Program Input

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