H. Shaun Kwak

Advancing material property prediction: using physics-informed machine learning models for viscosity

Alex K. Chew, Matthew Sender, Zachary Kaplan et al. · Journal of Cheminformatics · 2024 · 71 citations · Full text

Natural Sciences, Chemistry, Materials Science +17

First-Principles Study of Confinement Effects on the Raman Spectra of Si Nanocrystals

Khoong Hong Khoo, A. T. Zayak, H. Shaun Kwak et al. · Physical Review Letters · 2010 · 68 citations

Natural Sciences, Materials Science, Physics +17

Multifaceted peptide assisted one-pot synthesis of gold nanoparticles for plectin-1 targeted gemcitabine delivery in pancreatic cancer

Krishnendu Pal, Farah Al-suraih, Roberto González-Rodríguez et al. · Nanoscale · 2017 · 67 citations

Pharmacy, Oncology, Pharmaceutics +17

Quantum chemical package Jaguar: A survey of recent developments and unique features

Yixiang Cao, Ty Balduf, Michael D. Beachy et al. · The Journal of Chemical Physics · 2024 · 53 citations · Full text

Natural Sciences, Chemistry, Materials Science +17

Design of Organic Electronic Materials With a Goal-Directed Generative Model Powered by Deep Neural Networks and High-Throughput Molecular Simulations

H. Shaun Kwak, Yuling An, David J. Giesen et al. · Frontiers in Chemistry · 2022 · 39 citations · Full text

Natural Sciences, Materials Engineering, Materials Science +17