Results 301 to 310 of about 697,276 (400)

Software for molecular docking: a review

open access: yesBiophysical Reviews, 2017
N. S. Pagadala, K. Syed, J. Tuszynski
semanticscholar   +1 more source

deepTFBS: Improving within‐ and Cross‐Species Prediction of Transcription Factor Binding Using Deep Multi‐Task and Transfer Learning

open access: yesAdvanced Science, EarlyView.
DeepTFBS leverages deep learning to predict transcription factor binding sites across species, integrating multi‐task and transfer learning approaches to improve performance in data‐scarce scenarios. This study demonstrates enhanced accuracy in intra‐ and cross‐species prediction, revealing conserved regulatory patterns and functional variants.
Jingjing Zhai   +8 more
wiley   +1 more source

Knowledge Distillation for Molecular Property Prediction: A Scalability Analysis

open access: yesAdvanced Science, EarlyView.
This study explores the effectiveness of knowledge distillation (KD) for molecular property prediction using graph neural networks. By leveraging KD, student models achieve improved scalability and predictive accuracy across domain‐specific and cross‐domain molecular datasets.
Rahul Sheshanarayana, Fengqi You
wiley   +1 more source

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