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Y X Yu

3PUBLICATIONS

0CO-AUTHORS

Medical virologyPharmacogenomics

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Publications (3)

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|Nov 02, 2022

Decoding drug resistant mechanism of V32I, I50V and I84V mutations of HIV-1 protease on amprenavir binding by using molecular dynamics simulations and MM-GBSA calculations.

Y X Yu, W Wang, H B Sun

|Sep 23, 2021

Decoding molecular mechanism underlying binding of drugs to HIV-1 protease with molecular dynamics simulations and MM-GBSA calculations.

Y X Yu, W T Liu, H Y Li

|Jun 23, 2021

Insights into effect of the Asp25/Asp25' protonation states on binding of inhibitors Amprenavir and MKP97 to HIV-1 protease using molecular dynamics simulations and MM-GBSA calculations.

Y X Yu, W Wang, H B Sun

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