Novel solubility prediction models: Molecular fingerprints and physicochemical features vs graph convolutional neural networks S Lee, M Lee, KW Gyak, SD Kim, MJ Kim, K Min ACS omega 7 (14), 12268-12277, 2022 | 54 | 2022 |
MGCVAE: multi-objective inverse design via molecular graph conditional variational autoencoder M Lee, K Min Journal of chemical information and modeling 62 (12), 2943-2950, 2022 | 49 | 2022 |
A comparative study of the performance for predicting biodegradability classification: the quantitative structure–activity relationship model vs the graph convolutional network M Lee, K Min ACS omega 7 (4), 3649-3655, 2022 | 21 | 2022 |
Natural language processing techniques for advancing materials discovery: a short review JH Lee, M Lee, K Min International Journal of Precision Engineering and Manufacturing-Green …, 2023 | 10 | 2023 |
Evaluation of principal features for predicting bulk and shear modulus of inorganic solids with machine learning M Lee, M Kim, K Min Materials Today Communications 33, 104208, 2022 | 10 | 2022 |
AiKPro: deep learning model for kinome-wide bioactivity profiling using structure-based sequence alignments and molecular 3D conformer ensemble descriptors H Park, S Hong, M Lee, S Kang, R Brahma, KH Cho, JM Shin Scientific Reports 13 (1), 10268, 2023 | 5 | 2023 |
Prediction of protein aggregation propensity via Data-Driven approaches S Kang, M Kim, J Sun, M Lee, K Min ACS Biomaterials Science & Engineering 9 (11), 6451-6463, 2023 | 2 | 2023 |
AmorProt: Amino Acid Molecular Fingerprints Repurposing-Based Protein Fingerprint M Lee, K Min Biochemistry 62 (18), 2700-2709, 2023 | 1 | 2023 |
Matini-Net: Versatile Material Informatics Research Framework for Feature Engineering and Deep Neural Network Design M Lee, T Park, K Min Journal of Chemical Information and Modeling 64 (23), 8770-8783, 2024 | | 2024 |
ID: 4120981 A Step Forward in Predictive Cardiology: AI-Driven ECG Algorithm for Predicting the Occurrence of Intraventricular Conduction Abnormalities with Wide QRS Complex J KIM, M Lee, J Lim, S Jung, I Oh Heart Rhythm 21 (9), S783-S784, 2024 | | 2024 |
Evaluation of Principal Features for Predicting Elastic Properties of Inorganic Solids with Machine Learning M Lee, M Kim, K Min Available at SSRN 4091236, 0 | | |