Naisha Thakkar
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Toolkit & Resources

The technical stack and computational tools I use to bridge pharmaceutical sciences and machine learning.

Tools I Use Daily

Python

Core language for scripting, data analysis, and computational modeling

VS Code

Primary development environment

Git

Version control for every codebase and analysis pipeline

GitHub

Hosting reproductions, open notebooks, and portfolio code

Pandas

Data wrangling for genomics and chemical biological datasets

PyMOL

3D molecular visualization and structural analysis

Tools I Am Learning

PyTorch

Deep learning framework for building predictive models

RDKit

Cheminformatics toolkit for molecular structure handling

Biopython

Sequence alignment and structural bioinformatics in Python

ChEMBL API

Querying bioactivity and drug-target interaction data

AutoDock Vina

Molecular docking simulations and binding affinity estimation