Application of computational methods in understanding mutations in mycobacterium tuberculosis drug resistance

by Mugumbate, Grace, Nyathi, Brilliant, Zindoga, Albert, Munyuki, Gadzikano
Published 2022

TIBLE: a web-based, freely accessible resource for small-molecule binding data for mycobacterial species

by Malhotra, Sony, Mugumbate, Grace, Blundel, Tom L, Higueruelo, Alicia P
Published 2022

In silico comparison of antimycobacterial natural products with known antituberculosis drugs

by Espinoza-Moraga, Marlene, Njuguna, Nicholas M, Mugumbate, Grace, Caballero, Julio, Chibale, Kelly
Published 2022

Deorphaning anti-tuberculosis compounds using chemogenomic approaches and data from the ChEMBL database

by Mugumbate, G., Papadatos, G., Overington, J.P.
Published 2022

Computational Deorphaning of Mycobacterium tuberculosis Targets

by Bishi, Lorraine Yamurai, Vedithi, Sundeep Chaitanya, Blundell, Tom L., Mugumbate, Grace Chitima
Published 2022

Release of 50 new, drug-like compounds and their computational target predictions for open source anti-tubercular drug discovery

by Rebollo-Lopez, María Jose, Lelièvre, Joël, Alvarez-Gomez, Daniel, Castro-Piche, Julia, Martínez-Jiménez, Francisco, Papadatos, George, Kumar, Vinod, Colmenarejo, Gonzalo, Mugumbate, Grace, Hurle, Mark, Barroso, Vanessa, Young, Rob J, Martinez-Hoyos, María, González del Río, Rubén, Bates, Robert H, Lopez-Roman, Eva Maria, Mendoza-Losana, Alfonso, Brown, James R, Alvarez-Ruiz, Emilio, Marti-Renom, Marc A, Overington, John P, Cammack, Nicholas, Ballell, Lluís, Barros-Aguire, David
Published 2022

Mycobacterial Dihydrofolate Reductase Inhibitors Identified Using Chemogenomic Methods and In Vitro Validation

by Mugumbate, Grace, Abrahams, Katherine A., Cox, Jonathan A. G., Papadatos, George, Westen, Gerard van, Lelièvre, Joël, Calus, Szymon T., Loman, Nicholas J., Ballell, Lluis, Barros, David, Overington, John P., Besra, Gurdyal S.
Published 2022

A regional response to tuberculosis amid COVID-19 in southern Africa : towards eliminating silicosis and ending tuberculosis by 2030

by Khoza, Norman, Chamdimba, Chimwemwe, Moyo, Dingani, Chirime, Ivandra, Ng’andu, Brian Mutale
Published 2022

Target Identification of Mycobacterium tuberculosis Phenotypic Hits Using a Concerted Chemogenomic, Biophysical, and Structural Approach

by Mugumbate, Grace, Mendes, Vitor, Blaszczyk, Michal, Sabbah, Mohamad, Papadatos, George, Lelievre, Joel, Ballell, Lluis, Barros, David, Abell, Chris, Blundell, Tom L., Overington, John P.
Published 2022

3-Hydroxyisoflavanones from the stem bark of Dalbergia melanoxylon: Isolation, antimycobacterial evaluation and molecular docking studies

by Mutai, Peggoty, Heydenreich, Matthias, Thoithi, Grace, Mugumbate, Grace, Chibale, Kelly, Abiy Yenesew, Abiy
Published 2022