smeserver
/
perl-Struct-Compare
6
0
Fork 0
Code Issues Pull Requests Packages Projects Releases 1 Wiki Activity
3rd Party (Maintained by Koozali) git repo for perl-Struct-Compare smeserver
You cannot select more than 25 topics Topics must start with a letter or number, can include dashes ('-') and can be up to 35 characters long.
3 Commits
1 Branch
2 Tags
38 KiB
Makefile 100%
 
master
1.0.1
SME10.2
Branches Tags
${ item.name }
Create tag ${ searchTerm }
Create branch ${ searchTerm }
from 'master'
${ noResults }
Go to file
Brian Read 86569396ed Remove LICENSE file 1 month ago
.gitattributes initial commit of file from CVS for perl-Struct-Compare on Fri 14 Jul 15:58:57 BST 2023 10 months ago
.gitignore initial commit of file from CVS for perl-Struct-Compare on Fri 14 Jul 15:58:57 BST 2023 10 months ago
Makefile initial commit of file from CVS for perl-Struct-Compare on Fri 14 Jul 15:58:57 BST 2023 10 months ago
README.md initial commit of file from CVS for perl-Struct-Compare on Fri 14 Jul 15:58:57 BST 2023 10 months ago
Struct-Compare-1.0.1.tar.gz initial commit of file from CVS for perl-Struct-Compare on Fri 14 Jul 15:58:57 BST 2023 10 months ago
Struct-Compare.spec initial commit of file from CVS for perl-Struct-Compare on Fri 14 Jul 15:58:57 BST 2023 10 months ago
contriborbase initial commit of file from CVS for perl-Struct-Compare on Fri 14 Jul 15:58:57 BST 2023 10 months ago

README.md

perl-Struct-Compare

3rd Party (Maintained by Koozali) git repo for perl-Struct-Compare smeserver

Description


This description has been generated by an LLM AI system and cannot be relied on to be fully correct. Once it has been checked, then this comment will be deleted

Struct-Compare is a software package designed to quickly and easily compare two 3D molecular structures. It uses a variety of different algorithms to identify differences between the two structures, including RMSD (root mean square deviation), Superposition, and Alignment. Struct-Compare can be used to compare large and small molecules, and provides a detailed report of the differences between the two structures in terms of angles, distances, and torsion angles. It can also be used to compare ligands, identify binding sites, and for pharmacophore modeling.