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Department of Medicinal Chemistry · Deccan Institute of Scienceraolab@example.edu
RLRao Lab

Research

Four programmes, from finding a target to a molecule ready for preclinical studies.

  1. 01

    Antibiotics for resistant bacteria

    New classes of antibiotics against the bacteria that resist every drug we have.

    We focus on Gram-negative bacteria, whose double membrane keeps most drugs out.

    • New bacterial targets
    • Molecules that cross the outer membrane
    • Resistance studies from the start
  2. 02

    Structure-based design

    Crystal structures and simulations guide each molecule we make.

    We solve structures of our targets bound to inhibitors and use them, with free-energy calculations, to decide what to make next.

  3. 03

    High-throughput screening

    Robotic assays that test 100,000 compounds a week against live bacteria.

    Whole-cell screens find molecules that actually reach their target, and our counter-screens weed out toxic ones early.

  4. 04

    AI for medicinal chemistry

    Machine-learning models that predict which molecules will work, and which will be safe.

    We train models on our own screening data and use them to search billions of virtual molecules.