Lastest Update: 24th Jun 2024 

Conference Paper

• CDGCN: Conditional de novo Drug Generative Model Using Graph Convolution Networks
  Shikha Mallick and Sahely Bhadra
  International Conference on Research in Computational Molecular Biology (RECOMB 2023)
  Istanbul, Turkey. April, 2023.

• Physics and Data-Informed Formulation Design and Development for Chemical Processes
  Shikha Mallick, Francesca Boioli, Ravindra Aglave, Panos Petris, Peter Mas
  American Institute of Chemical Engineers (AIChE) Spring Meet 2023
  Houston, US. April, 2023. Slides.
  

MS Thesis

• Graph generative network for novel protein-specific de novo drug generation
  Shikha Mallick (Advisor: Dr. Sahely Bhadra).