Search
Results 41-50 of 66 (Search time: 0.009 seconds).
| NO | Title, Author(s) (Publication Title, Volume Issue, Page, Issue Date) |
|---|---|
| Lagrange-sinc basis set for efficient electronic structure calculations Kim, Woo Youn, 250th American Chemical Society National Meeting & Exposition, American Chemical Society, 2015-08-19 | |
| Configuration interaction calculation based on the real-space numerical grid method using Kohn-Sham orbitals Kim, Jae Wook; Hong, Kwang Woo; Choi, Sung Hwan; Hwang, Sang Yeon; Kim, Woo Youn, 16th International Conference on Density Functional Theory and its Applications(DFT2015), University of Debrecen, 2015-09-01 | |
| Configuration interactions based on the real-space numerical grid method: KohnSham vs HartreeFock orbitals Kim, Woo Youn, POSTECH Satellite Meeting on “Chemistry & Light”, POSTECH, 2015-08-07 | |
| Acceleration of Self-Consistent Field Procedure for Grid based method via High Quality Initial Guess Choi, Sung Hwan; Lim, Jae Chang; Kang, Sung Woo; Hong, Kwang Woo; Kim, Woo Youn, 16th International Conference on Density Functional Theory and its Applications(DFT2015) , University of Debrecen, 2015-09-01 | |
| Implementation of the double grid technique in real space Kohn-Sham method for fast and accurate calculations Ryu, Seong Ok; Choi, Sung Hwan; Kim, Woo Youn, 16th International Conference on Density Functional Theory and its Applications(DFT2015), University of Debrecen, 2015-09-03 | |
| Scaffold-based molecular design using a graph generative model Lim, Jaechang; Hwang, Sang-Yeon; Moon, Seokhyun; Kim, Seungsu; Kim, Woo Youn, 10th Triennial Congress of the International Society for Theoretical Chemical Physics, UiT The Arctic University of Norway, 2019-07-15 | |
| Fano Resonance in Molecular Electronics: Molecular Sensor and Spin-Valve Device Kim, Woo Youn, Annual World Congress of Smart Materials-2016, BIT Congress Inc., 2016-03-04 | |
| Predicting drug-target interaction using 3D structure-embedded graph representations from graph neural networks Lim, Jaechang; Ryu, Seongok; Park, Kyubyong; Choe, Yo Joong; Ham, Jiyeon; Kim, Woo Youn, The 5 th International Conference on Molecular Simulation, The Korean Institute of Metals and Materials, The Korea Institute of Science and Technology, Korea Advanced Institute of Science and Technology - ACE Team, Seoul National University, 2019-11-05 | |
| Efficient construction of chemical reaction network through Monte Carlo Tree Search Lee, Kyunghoon; Kim, Jin Woo; Kim, Woo Youn, The 5 th International Conference on Molecular Simulation, The Korean Institute of Metals and Materials, The Korea Institute of Science and Technology, Korea Advanced Institute of Science and Technology - ACE Team, Seoul National University, 2019-11-04 | |
| Bayesian's eye on molecular science: Bayesian deep optimization of Onsager-Machlup action learning for uncertainty quantification and active learning of molecular properties Ryu, Seongok; Kwon, Yongchan; Hwang, Sang-Yeon; Kim, Woo Youn, The 5 th International Conference on Molecular Simulation, The Korean Institute of Metals and Materials, The Korea Institute of Science and Technology, Korea Advanced Institute of Science and Technology - ACE Team, Seoul National University, 2019-11-04 |
Discover
Type
- 66 Conference