Concepedia

Implication of sulfonylurea derivatives as prospective inhibitors of human carbonic anhydrase II

Danish Idrees, Murtuza Hadianawala, Amarjyoti Das Mahapatra, Bhaskar Datta, Sonam Roy, Shahzaib Ahamad, Md. Imtaiyaz Hassan

International Journal of Biological Macromolecules · 2018 · 22 citations · 30 references

DOI

Concepts

References

30

GROMACS: Fast, flexible, and free

David van der Spoel, Erik Lindahl, Berk Hess et al. · Journal of Computational Chemistry · 2005 · 19.1K citations

, , +17

Automated docking using a Lamarckian genetic algorithm and an empirical binding free energy function

Garrett M. Morris, David S. Goodsell, Robert S. Halliday et al. · Journal of Computational Chemistry · 1998 · 10.8K citations

, , +17

<i>PRODRG</i>: a tool for high-throughput crystallography of protein–ligand complexes

Alexander W. Schüttelkopf, Daan M. F. van Aalten · Acta Crystallographica Section D Biological Crystallography · 2004 · 4.8K citations · Full text

, , +16

CASTp: computed atlas of surface topography of proteins with structural and topographical mapping of functionally annotated residues

Joseph Dundas, Zhengbiao Ouyang, Jeng‐Sen Tseng et al. · Nucleic Acids Research · 2006 · 1.7K citations · Full text

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Carbonic anhydrase inhibitors

Claudiu T. Supuran, Andrea Scozzafava, Angela Casini · Medicinal Research Reviews · 2002 · 1.4K citations

, , +12