PhotochemCAD™

calculational modules and databases of absorption and emission spectra for diverse compounds

Cyclaplex™


The Cyclaplex™ program was developed to simulate combinatorial processes that give rise to linear and cyclic oligomers.  The program is a generalization of PorphyrinViLiGe™ and is applicable to diverse macrocycles derived from modular constituents.  The program was conceived, developed and tested by Drs. Masahiko Taniguchi, Hai Du, and Jonathan S. Lindsey from Summer 2012 – Spring 2013.

The program and results are described in the following article:
"Enumeration of Virtual Libraries of Combinatorial Modular Macrocyclic (Bracelet, Necklace) Architectures and their Linear Counterparts,"
Taniguchi, M.; Du, H.; Lindsey, J. S. J. Chem. Info. Model. 2013, 53, 220–2216.


Installation

  1. Download and unzip Cyclaplex.zip
    this archive contains the following:
    • Example Files (folder)
    • CyclaPlex.exe
    • mwtable.csv
    • Reagetns.txt
  2. Open CyclaPlex.exe
  3. To explore the Example Files select File > Open
    from the menu and select an example

System Requirements

Windows operating system only
Microsoft .NET framework version >= 3.5 required


Current Version

The current version is Cyclaplex™ 1.0. To inquire about obtaining a preprint, please contact the authors.