Use of MM-PBSA in reproducing the binding free energies to HIV-1 RT of TIBO derivatives and predicting the binding mode to HIV-1 RT of efavirenz by docking and MM-PBSA

J. Wang, P. Morin, W. Wang, P. A. Kollman

Research output: Contribution to journalArticlepeer-review

637 Scopus citations

Fingerprint

Dive into the research topics of 'Use of MM-PBSA in reproducing the binding free energies to HIV-1 RT of TIBO derivatives and predicting the binding mode to HIV-1 RT of efavirenz by docking and MM-PBSA'. Together they form a unique fingerprint.

Engineering & Materials Science

Chemical Compounds

Medicine & Life Sciences