Tool stats & trends
Looking to identify usage trends or leading experts?
|Interface||Graphical user interface|
|Restrictions to use||License purchase required|
|Operating system||Unix/Linux, Mac OS, Windows|
No version available
- Documentation: https://www.biosolveit.de/SeeSAR/help/BeginnersGuide.pdf
- Video: https://youtu.be/1pTaokka7JM
Glucansucrase (mutant) enzymes from Lactobacillus reuteri 180 efficiently transglucosylate Stevia component rebaudioside A, resulting in a superior taste
[…] sed (maximum allowed overlap volume: 2 Å) and the maximum number of solutions per fragmentation was increased to 400. In total, 30 poses were generated with LeadIT, using the scoring function HYDE in SeeSAR, ranked according to their estimated affinity; finally, poses with torsions flagged in red were removed. Visual inspection of the residual poses and deletion of unreliable poses resulted in a t […]
Inhibition of the mechano enzymatic amyloidogenesis of transthyretin: role of ligand affinity, binding cooperativity and occupancy of the inner channel
[…] respectively) were examined using VMD, SPDBV, and Pymol (PyMOL Molecular Graphics System, Version 1.8 Schrödinger, LLC). The energetic contribution of the linker to the binding was estimated by the SeeSAR programme (https://www.biosolveit.de/SeeSAR). The halogen binding pockets considered in the analysis are formed by Met13, Lys15, Leu17, Thr106, Ala108, Val121 (HBP1); Lys17, Ala108, Ala109, Leu […]
A Role for Fragment Based Drug Design in Developing Novel Lead Compounds for Central Nervous System Targets
[…] Group) software; the latter can be used to cluster FTrees results by topology (). The fragment space extension module FTrees-FS allow a search of 1018 compounds in 5 min. BioSolveIT’s structure-based SeeSAR module provides receptor-binding affinity estimates that indicate atomic contributions within the compound, ranking hit compounds (also against known ligands, if desirable) even while they are […]
Looking to check out a full list of citations?
Be the first to review SeeSAR