H. Shaun Kwak

Citation name

Kwak, H. S.

Affiliation

Schrodinger, Inc.

State

MA

Country

USA

Authored

(595h) Data-Driven Prediction of Materials Properties in an Automated Fashion

Thomas J. L. Mustard

David J. Giesen

Thomas F. Hughes

Alexander Goldberg

Andrea Browning

Mathew D. Halls

2017 Annual Meeting (ISBN: 978-0-8169-1102-8)

(192g) Rapid and Accurate Property Prediction for Polymer Systems Using Atomistic-Scale Simulation

Thomas J. L. Mustard

Andrea Browning

Jeffrey Sanders

Mathew D. Halls

Alexander Goldberg

Stephen Christensen

Morisato Tsuguo

2017 Annual Meeting (ISBN: 978-0-8169-1102-8)

(192au) Dehydrogenation Mechanism of Liquid Organic Hydrogen Carrier Materials: A Density Functional Theory Study

2017 Annual Meeting (ISBN: 978-0-8169-1102-8)

(431b) Accessible DPD Models for Structured Formulations Via Automated and Atomistically-Driven Parameterization

David A. Nicholson

John C. Shelley

Andrea Browning

Mohammad Atif Faiz Afzal

Paulo G. M. Mileo

Mathew D. Halls

2022 Annual Meeting (ISBN: 978-0-8169-1118-9)

Associated proceedings

2017 Annual Meeting

2022 Annual Meeting