DeGrave, Alex J.

From local explanations to global understanding with explainable AI for trees

Lundberg, S. M., Erion, G., Chen, H., DeGrave, A., Prutkin, J. M., Nair, B., Katz, R., Himmelfarb, J., Bansal, N., & Lee, S.-I. (2020) · Nature Machine Intelligence

Explainable Artificial Intelligence (XAI)Artificial Intelligence in Healthcare

Cited by 10,551

AI for radiographic COVID-19 detection selects shortcuts over signal

DeGrave, A. J., Janizek, J. D., & Lee, S.-I. (2021) · Nature Machine Intelligence

COVID-19 diagnosis using AIExplainable Artificial Intelligence (XAI)

Cited by 631

Transparent medical image AI via an image–text foundation model grounded in medical literature

Kim, C., Gadgil, S. U., DeGrave, A. J., Omiye, J. A., Cai, Z. R., Daneshjou, R., & Lee, S.-I. (2024) · Nature Medicine

Artificial Intelligence in Healthcare and EducationExplainable Artificial Intelligence (XAI)

Cited by 125

WESTPA 2.0: High-performance upgrades for weighted ensemble simulations and analysis of longer-timescale applications

Russo, J. D., Zhang, S., Leung, J. M. G., Bogetti, A. T., Thompson, J. P., DeGrave, A. J., Torrillo, P. A., Pratt, A. J., Wong, K. F., Xia, J., et al. (2021) · Journal of Chemical Theory and Computation

Advanced Physical and Chemical Molecular InteractionsProtein Structure and Dynamics

Cited by 93

WESTPA 2.0: High-Performance Upgrades for Weighted Ensemble Simulations and Analysis of Longer-Timescale Applications

Russo, J. D., Zhang, S., Leung, J. M. G., Bogetti, A. T., Thompson, J. P., DeGrave, A. J., Torrillo, P. A., Pratt, A. J., Wong, K. F., Xia, J., et al. (2022) · Journal of Chemical Theory and Computation

Advanced Physical and Chemical Molecular InteractionsProtein Structure and Dynamics

Cited by 93

The RED scheme: Rate-constant estimation from pre-steady state weighted ensemble simulations

DeGrave, A. J., Bogetti, A. T., & Chong, L. T. (2018) · The Journal of Chemical Physics

Protein Structure and DynamicsAdvanced Physical and Chemical Molecular Interactions

Cited by 20