Diwakar Shukla

University of Illinois at Urbana-Champaign

Molecular Biosciences


B. Selvam, Z. Shamsi and D. Shukla (2017): Universality of sodium ions binding mechanism in GPCRs
Z. Shamsi and D. Shukla (2017): Concestor kinase activation mechanism uncovers the Cyclin dependence of CDK family kinases, (submitted)
Saurabh Shukla, Zahra Shamsi, Alexander S. Moffett, Balaji Selvam, and Diwakar Shukla (2017): Application of Hidden Markov Models in Biomolecular Simulations, Methods in Molecular Biology, Springer New York, Hidden Markov Models, pp29--41


K. Bender Moffett, S.C. Huber, and D. Shukla (2016): Conformational Engineering of αC Helix for Regulating the Activity of Plant Kinases, (submitted)
Diwakar Shukla, Ariana Peck, and Vijay S. Pande (2016): Conformational Heterogeneity of the Calmodulin Binding Interface, Nature Communications, Nature Publishing Group, Vol 7, pp10910


Moffett et al. (2015): Guiding Functional Dynamics and Dimerization of Proteins Using Evolutionary Couplings, Journal of Chemical Theory and Computation