B.2 Obsolete Parameters for Proteins

B.2.1 PARMEXEL

Title found in the run creating the parameters:

     *   PARAMETER FILE FOR EXEL VERSION 11 CREATION RUN
     *   HYDROGEN BOND STRENGTHS INCREASED BY 1.0 KCAL/MOLE FROM PARMFIX11
     *   LENGTHS DECREASED BY 0.1-0.2 ANGSTROM WALLWORK ACTA. CRYST. (66) 15:758
     *       7-Apr-1981  21:33:52 - DJS

Title written to the binary file:

     *   PARAMETER  VERSION 10 -- EXTENDED AND EXPLICIT SET -- 27 ATOM TYPES
     *   COMPILED BY WFVG, SNS AND BDO -- MARCH 1979
     *   HYDROGEN BOND PARAMETERS CHANGED FROM VERSION 5 -- ONLY O-O,O-N,N-N
     *   H BOND STRENGTHS INCREASED 1.0 KCAL/MOLE FOR EXEL LENGTHS SHORTENED
     *   NONBONDED PARAMETERS FOR HYDROGEN (A-0.044,N-1,R-0.8 == EMIN-0.1)
     *   PHIS INVOLVING C(CARBONYL) AND NITROGENS MADE CONSISTENT IN VER. 8
     *   O-H BOND FORCE CONSTANTS CHANGED TO 400.0 IN VERSION 9
     *   ADDED ANGLE FOR N-TERMINAL PROLINE -- BRUC
     *   LAST UPDATE 7-Apr-1981  21:20:20