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. Author manuscript; available in PMC: 2011 Apr 13.

Published in final edited form as: J Chem Theory Comput. 2010 Apr 13;6(4):1401–1412. doi: 10.1021/ct900676b

(A) and (B) are titration curves of Asp3, Lys5 and Tyr7 in the heptapeptide derived from protein OMTKY3. (C) shows the Hill’s plots of Asp3. The pKa values of Asp3 are found through Hill’s plots.

(A) and (B) are titration curves of Asp3, Lys5 and Tyr7 in the heptapeptide derived from protein OMTKY3. (C) shows the Hill’s plots of Asp3. The pKa values of Asp3 are found through Hill’s plots.