M
Menglun Wang
Researcher at Michigan State University
Publications - 14
Citations - 897
Menglun Wang is an academic researcher from Michigan State University. The author has contributed to research in topics: Deep learning & Infectivity. The author has an hindex of 7, co-authored 14 publications receiving 461 citations.
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Mutations Strengthened SARS-CoV-2 Infectivity.
TL;DR: It is shown that most likely future mutations will make SARS-CoV-2 more infectious, and it is predicted that a few residues on the receptor-binding motif (RBM) have high chances to mutate into significantly more infectious COVID-19 strains.
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Mathematical deep learning for pose and binding affinity prediction and ranking in D3R Grand Challenges
TL;DR: The authors' models obtained the top place in absolute free energy prediction for free energy set 1 in stage 2 and were ranked 1st in 10 out of 26 official competitive tasks for GC3.
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A topology-based network tree for the prediction of protein-protein binding affinity changes following mutation.
TL;DR: Tests indicate that the proposed topology-based network tree is an important improvement over the current state of the art in predicting ΔΔ G, and proposes a new deep learning algorithm called NetTree to take advantage of convolutional neural networks and gradient-boosting trees to improve predictions of protein–protein interactions.
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Rigidity Strengthening: A Mechanism for Protein-Ligand Binding.
TL;DR: The approach based solely on rigidity is able to unveil a surprisingly apparently long-range contribution of apparently four residue layers to protein-ligand binding, which has ramifications for drug and protein design.
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MathDL: mathematical deep learning for D3R Grand Challenge 4
TL;DR: In the D3R Grand Challenge 4 (GC4), Wang et al. as discussed by the authors presented the performances of their mathematical deep learning (MathDL) models for pose prediction, affinity ranking, and free energy estimation for beta secretase 1 (BACE) as well as affinity ranking for Cathepsin S (CatS).