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"Lead optimization mapper: automating free energy calculations for lead ..."
Shuai Liu et al. (2013)
- Shuai Liu, Yujie Wu, Teng Lin, Robert Abel, Jonathan P. Redmann, Christopher M. Summa, Vivian R. Jaber, Nathan M. Lim, David L. Mobley:
Lead optimization mapper: automating free energy calculations for lead optimization. J. Comput. Aided Mol. Des. 27(9): 755-770 (2013)
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