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Protein structure

Morphoscanner2.0: A new python module for analysis of molecular dynamics simulations

Federico Fontana, Calogero Carlino, Ashish Malik, Fabrizio Gelain

In silico elucidation of potential drug targets against oxygenase domain of Human eNOS Dysfunction

Abbeha Malik, Muhammad Nasir Iqbal, [ ... ], Sheikh Arslan Sehgal

MTSviewer: A database to visualize mitochondrial targeting sequences, cleavage sites, and mutations on protein structures

Andrew N. Bayne, Jing Dong, [ ... ], Jean-François Trempe

Obscurin Rho GEF domains are phosphorylated by MST-family kinases but do not exhibit nucleotide exchange factor activity towards Rho GTPases in vitro

Daniel Koch, Ay Lin Kho, [ ... ], Mathias Gautel

Proteogenomic analysis of Serratia marcescens using computational subtractive genomics approach

Sharon Elaine D’Souza, Kanwal Khan, Reaz Uddin

Molecular dynamics of the ERRγ ligand-binding domain bound with agonist and inverse agonist

Santanu Sasidharan, Kamalakannan Radhakrishnan, [ ... ], Donghyun Shin

Interleukin-10 as Covid-19 biomarker targeting KSK and its analogues: Integrated network pharmacology

Vidhya Rajalakshmi V., Akilandeswari Ramu, [ ... ], Thangavelu Sathiamoorthi

Modification of the structural stability of human serum albumin in rheumatoid arthritis

Hsien-Jung L. Lin, David H. Parkinson, [ ... ], John C. Price

Using AlphaFold to predict the impact of single mutations on protein stability and function

Marina A. Pak, Karina A. Markhieva, [ ... ], Dmitry N. Ivankov

Exploring the structural basis to develop efficient multi-epitope vaccines displaying interaction with HLA and TAP and TLR3 molecules to prevent NIPAH infection, a global threat to human health

Sukrit Srivastava, Sonia Verma, [ ... ], Michael Kolbe

B-cell epitope discovery: The first protein flexibility-based algorithm–Zika virus conserved epitope demonstration

Daniel W. Biner, Jason S. Grosch, Peter J. Ortoleva

A deep graph convolutional neural network architecture for graph classification

Yuchen Zhou, Hongtao Huo, Zhiwen Hou, Fanliang Bu

Multi-store collaborative delivery optimization based on Top-K order-split

Yanju Zhang, Liping Ou, Jiaxu Liu

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