Yammp Shell
Introduction
Simple Commands
Modify the Molecular Environment
Modify the Linesearch Methods for Energy Minimization
Modify the Energy Minimization Methods
Modify the Molecular Dynamics Methods
Modify the Monte Carlo Methods
Modify the Non-Bond Terms During a Simulation
Modify Bond Constraints for Molecular Dynamics
Modify the CONTRA-MD Method
Defining and Invoking Macros
define macroname numarg
      statement
      ...
end

Define a macro named macroname with numarg arguments containing statement ... Within the definition, the arguments are referenced as $1, $2, up to $numarg and may contain any statement except define. Macros may call other macros and itself. Macro definition using a ysh command name will be lost, i.e., although you can define them they are not accessible.

macroname $1 ...

Invoke the previously defined macro named macroname with the arguments $1 .... The right number of arguments must be supplied and they must be of the correct types.


Control Structures
Examples

 


des format
arc format
yammp shell
exam commands
intro
arc
arcedit
arctransform
checkspider
des
elec2vlat

exam
mimesis
mkchainarc
mkchaindes
mkd3c
mkd3d
mkr2cc
mksnac
mksnad
xmd3
xmr2
ympf

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