Sirish Kaushik Lakkaraju

Inclusion of Multiple Fragment Types in the Site Identification by Ligand Competitive Saturation (SILCS) Approach

E. Prabhu Raman, Wenbo Yu, Sirish Kaushik Lakkaraju et al. · Journal of Chemical Information and Modeling · 2013 · 130 citations · Full text

Engineering, Hit Identification, Chemical Analysis +23

Sampling of Organic Solutes in Aqueous and Heterogeneous Environments Using Oscillating Excess Chemical Potentials in Grand Canonical-like Monte Carlo-Molecular Dynamics Simulations

Sirish Kaushik Lakkaraju, E. Prabhu Raman, Wenbo Yu et al. · Journal of Chemical Theory and Computation · 2014 · 97 citations

Pharmacophore Modeling Using Site-Identification by Ligand Competitive Saturation (SILCS) with Multiple Probe Molecules

Wenbo Yu, Sirish Kaushik Lakkaraju, E. Prabhu Raman et al. · Journal of Chemical Information and Modeling · 2015 · 80 citations

Silcs-pharm Protocol, Drug Target, Engineering +15

Optimization and Evaluation of Site-Identification by Ligand Competitive Saturation (SILCS) as a Tool for Target-Based Ligand Optimization

Vincent D. Ustach, Sirish Kaushik Lakkaraju, Sunhwan Jo et al. · Journal of Chemical Information and Modeling · 2019 · 75 citations · Full text

Drug Target, Hit Identification, Target-based Ligand Optimization +22

Site-Identification by Ligand Competitive Saturation (SILCS) assisted pharmacophore modeling

Wenbo Yu, Sirish Kaushik Lakkaraju, E. Prabhu Raman et al. · Journal of Computer-Aided Molecular Design · 2014 · 67 citations · Full text

Medicinal Chemistry, Biochemistry, Medicine +7