As an accomplished Computational Chemist, I specialize in lead optimization and the application of advanced computational techniques to enhance drug discovery processes. With a strong foundation in molecular dynamics simulations, free energy perturbation calculations, and both ligand- and structure-based drug design, I bring a wealth of expertise and innovation to the field.During my tenure at the Voelz Lab at Temple University, I utilized open-source MD frameworks through Folding@Home to conduct all-atom, long-timescale molecular dynamics simulations, evaluating the binding mechanisms and kinetics of protein-ligand complexes as well as evaluating Expanded Ensemble free energy calculations for thousands of compounds in partnership with the COVID Moonshot mission.At Nested Therapeutics, I contributed to multiple programs using a diverse array of tools ranging from literature- and modeling-based target assessment, deploying ligand FEP to evaluate binding affinities, stability- and affinity-based Protein FEP to predict resistance mutations, conducting SAR trend analyses to inform prospective design, matched pair analyses, and ADME property predictions.I have also worked to reconcile simulated structures with experimental observables (HDX/NMR) and re-weight simulated ensembles and generate relevant conformers to bolster understanding of protein dynamics.My technical skills encompass:Software Programming (Python & Bash)GNU/Unix, HPC, AWS ExpertiseSchrodinger Suite, D360, KNIMEAll-Atom Molecular Dynamics SimulationsFree Energy CalculationsMachine-Learning / Generative AIIn addition to my core expertise, I have a keen interest in:Incorporating generative deep-learning methods to design novel and optimized drug candidates.Integrating GPU acceleration into computational methods.Developing virtual and augmented reality applications for molecular modeling and drug design.Exploring breakthroughs in Natural Language Processing and refinement of LLMs.With strong project and cluster administration skills, I have overseen software upgrades, expanded scientific workflow documentation, and mentored team members. My interpersonal communication abilities further enhance my collaborative and leadership capabilities.I am passionate about pushing the boundaries of computational chemistry and drug discovery, constantly seeking innovative solutions and staying abreast of the latest advancements in the field.