Functionally specified protein signatures distinctive for each of the different blue copper proteins. - Anuradha Vivekanandan Giri; Sharmila Anishetty; Pennathur Gautam (BMC Bioinform., 2004)

Potential drug targets in Mycobacterium tuberculosis through metabolic pathway analysis. - Sharmila Anishetty; Mrudula Pulimi; Pennathur Gautam (Comput. Biol. Chem., 2005)

Evidence of a Double-Lid Movement in Pseudomonas aeruginosa Lipase: Insights from Molecular Dynamics Simulations. - Subbulakshmi Latha Cherukuvada; Aswin Sai Narain Seshasayee; Krishnan Raghunathan; Sharmila Anishetty; Pennathur Gautam (PLoS Comput. Biol., 2005)

In silico identification of putative metal binding motifs. - Richard Thilakaraj; Krishnan Raghunathan; Sharmila Anishetty; Pennathur Gautam (Bioinform., 2007)

Global metal-ion Binding protein Fingerprint: a Method to Identify Motif-Less metal-ion Binding proteins. - Abhilash Mohan; Sharmila Anishetty; Pennathur Gautam (J. Bioinform. Comput. Biol., 2010)

Understanding the lid movements of LolA in Escherichia coli using molecular dynamics simulation and in silico point mutation. - Priyadarshini Murahari; Sharmila Anishetty; Pennathur Gautam (Comput. Biol. Chem., 2013)

Molecular dynamics simulations of lectin domain of FimH and immunoinformatics for the design of potential vaccine candidates. - Muthukumar Singaravelu; Anitha Selvan; Sharmila Anishetty (Comput. Biol. Chem., 2014)

Cavities create a potential back door in epoxide hydrolase Rv1938 from Mycobacterium tuberculosis - A molecular dynamics simulation study. - Anitha Selvan; Sharmila Anishetty (Comput. Biol. Chem., 2015)

A pipeline for proteome-scale identification and studies on hormone sensitive lipases in Mycobacterium tuberculosis. - Durairaj Sherlin; Sharmila Anishetty (Comput. Biol. Chem., 2017)