CurriculumVitae
Tubhyam Karthikeyan — Computational Chemist & ML Researcher
Education
B.Tech Chemical Engineering
Institute of Chemical Technology, Mumbai
Focus: Computational chemistry, machine learning for spectroscopy
Skills
Languages
Python TypeScript Rust C++ MATLAB
ML / DL
PyTorch JAX scikit-learn Hugging Face CUDA
Chemistry
DFT Vibrational Spectroscopy Chemometrics Molecular Dynamics
Tools
Git Docker Linux LaTeX Astro React
Selected Projects
Spekron
Lead DeveloperHybrid Mamba-Transformer foundation model for vibrational spectroscopy with VIB disentanglement and MoE routing.
SpectraKit
Creator & MaintainerPublished Python library for spectral preprocessing — baseline correction, smoothing, normalization, peak analysis. 619 tests, PyPI v1.7.1.
ReactorTwin
Lead DeveloperSurrogate digital twin for chemical reactors using Neural ODEs and PINNs.