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MOLMOL Manual

20. Configuration

All configuration files are stored in the subdirectory setup of the MOLMOL installation directory. The system admistrator can make site specific changes in these files.

With the PathNames command, each user can select files different from the default ones. For doing this, it is recommended to copy the default file to a place in the home directory and make the desired changes.

The following is a list of configuration files:

name

description

MenuBar

names and mnemonics of all pulldown menus

*.menu

entries of all pulldown menus

Popup

entries in the popup menu

Buttons

definition of buttons

Valuator

entries in the valuator box

amber94.lib

residue library

PdbAtoms

translation table for PDB atom names

AtomRadius

data for the commands MakeBonds and CheckBonds

AtomCharge

charges referenced in expressions by simplecharge

FlipAtoms

data for the command FlipAtom

RingShift

data for the command CalcShift

PropDef

predefined properties

ColorList

list of colors for color dialog

If there is a macro with the name startup.mac in the subdirectory molmol of the home directory of the user, it is automatically executed when the program is started up.


MOLMOL Manual - 7 Oct 1997

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