Exploring Spirocyclic Isoquinoline-Piperidine Compounds in Tuberculosis Therapy: ADMET Profiling, Docking, DFT, MD Simulations, and MMGBSA Analysis DOI

Sri Mounika Bellapukonda,

Siva Singothu,

Anuradha Singampalli

et al.

Computational Biology and Chemistry, Journal Year: 2025, Volume and Issue: 118, P. 108447 - 108447

Published: April 5, 2025

Language: Английский

Exploring Spirocyclic Isoquinoline-Piperidine Compounds in Tuberculosis Therapy: ADMET Profiling, Docking, DFT, MD Simulations, and MMGBSA Analysis DOI

Sri Mounika Bellapukonda,

Siva Singothu,

Anuradha Singampalli

et al.

Computational Biology and Chemistry, Journal Year: 2025, Volume and Issue: 118, P. 108447 - 108447

Published: April 5, 2025

Language: Английский

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