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Molecular Informatics|September 14, 2023
AliNA - a deep learning program for RNA secondary structure predictionShamsudin S Nasaev, Artem R Mukanov, Ivan I Kuznetsov, et al.
Molecular Informatics|February 15, 2024
An ensemble-based approach to estimate confidence of predicted protein-ligand binding affinity valuesMilad Rayka, Morteza Mirzaei, Ali Mohammad Latifi
Molecular Informatics|January 30, 2024
The macrocycle inhibitor landscape of SLC-transporterNejra Granulo, Sergey Sosnin, Daniela Digles, et al.
Molecular Informatics|June 5, 2024
BIOMX-DB: A web application for the BIOFACQUIM natural product databaseFernando Martínez-Urrutia, José L Medina-Franco
Molecular Informatics|June 8, 2024
Accelerating Molecular Docking using Machine Learning MethodsAbdulsalam Y Bande, Sefer Baday
Molecular Informatics|October 15, 2024
Pathway-based prediction of the therapeutic effects and mode of action of custom-made multiherbal medicinesAkihiro Ezoe, Yuki Shimada, Ryusuke Sawada, et al.
Molecular Informatics|November 23, 2024
The Chemical Space Spanned by Manually Curated Datasets of Natural and Synthetic Compounds with Activities against SARS-CoV-2Jude Y Betow, Gemma Turon, Clovis S Metuge, et al.
Molecular Informatics|May 25, 2026
A Structure-Informed Atlas of Venom-Derived Peptides Reveals the Organization of Chemical SpaceThaís Caroline Gonçalves, Eduardo Henrique Toral Cortez, Danilo T Amaral
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