Molecular dynamics simulations as a guide for modulating small molecule aggregation

Azam Nesabi, Jas Kalayan, Sara Al Rawashdeh, Mohammad A. Ghattas, Richard A. Bryce. Molecular dynamics simulations as a guide for modulating small molecule aggregation. Journal of Computer-Aided Molecular Design, 38(1):11, December 2024. [doi]

Authors

Azam Nesabi

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Jas Kalayan

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Sara Al Rawashdeh

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Mohammad A. Ghattas

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Richard A. Bryce

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