MAESTRO 11 specifications

Information


Unique identifier OMICS_18941
Name MAESTRO 11
Software type Application/Script
Interface Graphical user interface
Restrictions to use None
Operating system Unix/Linux, Mac OS, Windows
Computer skills Medium
Stability Stable
Maintained Yes

Versioning


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Maintainer


  • person_outline QikProp Team <>

Additional information


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MAESTRO 11 in publications

 (7)
PMCID: 5955141
PMID: 29774130
DOI: 10.18632/oncotarget.25243

[…] nilotinib (pdb id: 3cs9) and arg complexed with imatinib (pdb id: 3gvu) were structurally aligned. gnf-5 was flexibly aligned over gnf-2 using largest common bemis-murcko scaffold in schrödinger’s maestro 11.0 []., mda-mb-231 cells were re-suspended to a concentration of 3 × 104 cells/ml in dmem/10% fbs and plated at 100 μl/well in triplicates in flat bottom 96 well microtiter plates. […]

PMCID: 5867633
PMID: 29534435
DOI: 10.3390/md16030089

[…] 11 were due to a different conformational behaviour. we therefore sampled the conformational space of compounds 10, 11, and 13 by using the macrocycle conformational sampling routine implemented in maestro 11.2 (schroedinger inc.) []. conformational ensembles that were obtained from the macrocycle search evidenced that all the compounds covered the same conformational space (), albeit […]

PMCID: 5841289
PMID: 29515203
DOI: 10.1038/s41598-018-22388-5

[…] and re-probed with rabbit anti-histone h3 antibody. chemiluminescent signal detection and image acquisition were carried out using ecl prime western blotting detection reagents., in docking studies, maestro 11.0.015 was used (small-molecule drug discovery suite 2016-4, schrödinger, llc, new york, ny, 2016)., sirt6 protein structure was downloaded from rcsb protein data bank (pdb id: 3zg6). […]

PMCID: 5879945
PMID: 29618901
DOI: 10.6026/97320630014060

[…] [] and another inverse agonist bound (also the inactive state of the receptor), 5jqh [] conformations from the protein data bank (www.rcsb.org). protein structures were viewed on the schrodinger maestro 11.1, version 2017-1. lysozyme, water molecules as well as other noninteracting ligands were removed. a complete protein preparation was performed using the protein preparation wizard. […]

PMCID: 5747330
PMID: 29333236
DOI: 10.5256/f1000research.13316.r25511

[…] and lipinski rule of five were also analyzed by perl script, “calculatephysicochemicalproperties.pl” of mayachemtools ., the protein-ligand complex interaction at the atomic level was analyzed using maestro 11.0 (llc schrodinger 2016) and ligplot+ v1.4.5. the protein and the docked ligand were merged together and uploaded to maestro suite vmaestro 11. further, the “ligand interaction diagram” […]


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