Xin Wang

Xin Wang Email and Phone Number

Graduate Research Assistant at Virginia Tech | AI for Science | Molecule Discovery @ Virginia Tech
Xin Wang's Location
Blacksburg, Virginia, United States, United States
About Xin Wang

As a dedicated PhD student and Graduate Research Assistant at Virginia Tech, I am deeply engaged in (1) predicting key properties of surfactants by using Graph Neural Networks (2) discovering efficient and eco-friendly surfactants for firefighting foams across ~2.8 M candidates using deep learning-enabled active learning.My work leverages machine learning, deep learning, and molecular dynamics simulations. I am passionate about AI for Science, particularly in AI-accelerated molecule discovery.

Xin Wang's Current Company Details
Virginia Tech

Virginia Tech

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Graduate Research Assistant at Virginia Tech | AI for Science | Molecule Discovery
Xin Wang Work Experience Details
  • Virginia Tech
    Graduate Research Assistant
    Virginia Tech May 2021 - Present
    Blacksburg, Virginia, United States
    • designed a BERT model-based recommendation system for electrolyte search over 10, 000 electrolytes, where a two-tower model was employed for candidate generation and Multimodal Mixtures of Experts (MMoE) were implemented for fine-ranking• developed an active learning framework for rapid molecule discovery over 2.8 million candidates, where a GNN-based auto-encoder embedded molecular graphs into low-dimensional latent space for sampling, a Gaussian Regression Model was employed for prediction and Bayesian Optimization was utilized to select next round of promising candidates• utilized the Graph Convolutional Networks to predict key properties of materials• performed high-performance computing (HPC) on a large dataset of molecules (Python, shell script)
  • Beijing University Of Chemical Technology
    Graduate Research Assistant
    Beijing University Of Chemical Technology Sep 2017 - Jul 2020
    Chaoyang District, Beijing, China
    1. Design and Analysis of Storage Tanks in Solar Thermal Power Plants Located in Delingha and Hami∙ conducted the stress assessment, eigenvalue buckling analysis, and fatigue and creep assessment of the molten-salt storage tank under multiple workloads by employing Finite Element Analysis∙ performed the thermal analysis of the preheating and salt-filing processes of the storage tank through Ansys Fluent∙ These storage tanks I designed have been performing exceptionally well, contributing to the Delingha power plant's successful generation of 152.4 million kWh of electricity in 2023.

Xin Wang Education Details

Frequently Asked Questions about Xin Wang

What company does Xin Wang work for?

Xin Wang works for Virginia Tech

What is Xin Wang's role at the current company?

Xin Wang's current role is Graduate Research Assistant at Virginia Tech | AI for Science | Molecule Discovery.

What schools did Xin Wang attend?

Xin Wang attended Virginia Tech, Beijing University Of Chemical Technology, Beijing University Of Chemical Technology.

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