Concepedia

Design and synthesis of novel 1H-tetrazol-5-amine based potent antimicrobial agents: DNA topoisomerase IV and gyrase affinity evaluation supported by molecular docking studies

Daniel Szulczyk, Michał A. Dobrowolski, Piotr Roszkowski, Anna Bielenica, Joanna Stefańska, Michał Koliński, Sebastian Kmiecik, Michał Jóźwiak, Małgorzata Wrzosek, Wioletta Olejarz,

European Journal of Medicinal Chemistry · 2018 · 42 citations · 34 references

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References

34

A short history of<i>SHELX</i>

George M. Sheldrick · Acta Crystallographica Section A Foundations of Crystallography · 2007 · 87.4K citations · Full text

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VMD: Visual molecular dynamics

William Humphrey, Andrew Dalke, Klaus Schulten · Journal of Molecular Graphics · 1996 · 66.6K citations

, , +12

AutoDock4 and AutoDockTools4: Automated docking with selective receptor flexibility

Garrett M. Morris, Ruth Huey, William Lindstrom et al. · Journal of Computational Chemistry · 2009 · 25K citations · Full text

, , +13

Phase annealing in SHELX-90: direct methods for larger structures

George M. Sheldrick · Acta Crystallographica Section A Foundations of Crystallography · 1990 · 16.3K citations

, , +15

An Automated Force Field Topology Builder (ATB) and Repository: Version 1.0

Alpeshkumar K. Malde, L. Zuo, Matthew Breeze et al. · Journal of Chemical Theory and Computation · 2011 · 1.9K citations

, , +17