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Thi Ngoc Lan Vu

2 results in Authors: Thi Ngoc Lan Vu

Theoretical and Computational Chemistry

Integrating Machine Learning-Based Pose Sampling with Established Scoring Functions for Virtual Screening

Thi Ngoc Lan Vu, Hosein Fooladi, Johannes Kirchmair

Version 2 posted 24 February 2025

278

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Theoretical and Computational Chemistry

Evaluating Machine Learning Models for Molecular Property Prediction: Performance and Robustness on Out-of-Distribution Data

Hosein Fooladi, Thi Ngoc Lan Vu, Johannes Kirchmair

Version 2 posted 06 March 2025

388

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