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Achievements

Achievement: Pull SharkAchievement: Quickdraw

Achievements

Achievement: Pull SharkAchievement: Quickdraw

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adaogomesl/README.md

About Me

I am a Ph.D. candidate in the Lopez Lab at Northeastern University, with a B.S. in Chemistry from Suffolk University (2021). I am a first-generation Latina researcher specializing in computational chemistry and photochemistry.

Research Focus

  • High-throughput virtual screening to discover novel organic photoredox catalysts
  • Investigating mechanistic pathways and stereoselectivity in photochemical reactions
  • Developing computational tools to drive sustainable innovations in photochemistry
  • Training Equivariant Neural Network to predict excited state couplings

Research Overview

Science

Leadership & Outreach

I am actively involved in scientific leadership and outreach through American Chemical Society, ADSE and Northeastern

📫 Contact
🔗 LinkedIn

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  1. qm-redox-potentials qm-redox-potentials Public

    Python code to automate quantum mechanical (QM) calculations, extract results, and analyze data for excited-state redox potentials. This includes input generation, job submission, parsing output fi…

    Python

  2. QM-Non-adiabatic-Molecular-Dynamics QM-Non-adiabatic-Molecular-Dynamics Public

    This repository contains scripts and step-by-step explanation on how submit and analyze CASSCF non-adiabatic molecular dynamics.

    Python 1