InpMerge
CHARMM Parameter Merger

 

1.0 Introduction

InpMerge is a shell command that can be used to merge the CHARMM/NAMD parameter files in order to obtain a single file. This is useful to when you need a parameter file containing custom data saved by the missing parameter table.

 

2.0 Installation & usage

The software is installed automatically with VEGA ZZ and it requires the locale.dll and the hdrive.dll to work properly. The program must  be executed from the command prompt, selecting VEGA ZZ -> VEGA Console in the Start menu.

Synopsis:

InpMerge   <OUTPUT>   <INPUT1>   <INPUT2> ...

<OUTPUT>   

This is the name of the CHARMM/NAMD parameter output file (.inp).

<INPUT1>
<INPUT2>
...
  There are the name of the CHARMM/NAMD parameter input files (.inp). InpMerge supports files containing the INCLUDE directive.

 

3.0 History

 

4.0 Copyright and disclaimers

All trademarks and software directly or indirectly referred in this document, are copyrighted from legal owners. InpMerge is a freeware program and can be spread through Internet, BBS, CD-ROM and other electronic formats. The Authors of this program accept no responsibility for hardware/software damages resulting from the use of this package. No warranty is made about the software or its performance.

Use and copying of this software and the preparation of derivative works based on this software are permitted, so long as the following conditions are met:

   

InpMerge
is a software to merge the CHARMM parameter files
Copyright 2006-2013, Alessandro Pedretti & Giulio Vistoli
All rights reserved.

Alessandro Pedretti
Dipartimento di Scienze Farmaceutiche
UniversitÓ degli Studi di Milano
Via Mangiagalli, 25
I-20133 Milano - Italy
Tel. +39 02 503 19332
Fax. +39 02 503 19359
E-Mail: info@vegazz.net
WWW: http://www.vegazz.net