COMPLIG
:: DESCRIPTION
COMPLIG is the desktop ligand molecule superposition tool for Windows system
::DEVELOPER
Nagahama Institute of Bio-Science and Technology
:: SCREENSHOTS
:: REQUIREMENTS
- Windows
:: DOWNLOAD
:: MORE INFORMATION
:: DESCRIPTION
COMPLIG is the desktop ligand molecule superposition tool for Windows system
::DEVELOPER
Nagahama Institute of Bio-Science and Technology
:: SCREENSHOTS
:: REQUIREMENTS
:: DOWNLOAD
:: MORE INFORMATION
:: DESCRIPTION
COMPPDB is the desktop PDB superposition tool for Windows system
::DEVELOPER
Nagahama Institute of Bio-Science and Technology
:: SCREENSHOTS
:: REQUIREMENTS
:: DOWNLOAD
:: MORE INFORMATION
:: DESCRIPTION
WURSTL is a software for two proteins structural superposition and alignment.
::DEVELOPER
Center for Bioinformatics (ZBH), University of Hamburg
:: SCREENSHOTS
N/A
:: REQUIREMENTS
:: DOWNLOAD
:: MORE INFORMATION
:: DESCRIPTION
FlexS is a computer program for predicting ligand superpositions. For a given pair of ligands, FlexS predicts the conformation and orientation of one of the ligands relative to the other one. In FlexS the reference-ligand is assumed to be rigid, thus, it should be given in a conformation which is similar to the bound state. The superposition algorithm in FlexS requires only little manual intervention. Nevertheless, in some cases additional information about the ligands or even the superposition is known. You can integrate this knowledge into the computations with FlexS by carrying out single steps manually. Thus, FlexS is designed for interactive work on ligand pairs as well as for ligand-based virtual screening.
::DEVELOPER
:: SCREENSHOTS
N/A
:: REQUIREMENTS
:: DOWNLOAD
:: MORE INFORMATION
Citation
C. Lemmen, T. Lengauer, and G. Klebe.
FLEXS: A method for fast flexible ligand superposition.
Journal of Medicinal Chemistry, 41:4502–4520, 1998.