Absolute and relative pKa predictions via a DFT approach applied to the SAMPL6 blind challenge
Crossref DOI link: https://doi.org/10.1007/s10822-018-0150-x
Published Online: 2018-08-20
Published Print: 2018-10
Update policy: https://doi.org/10.1007/springer_crossmark_policy
Zeng, Qiao http://orcid.org/0000-0001-7888-0798
Jones, Michael R.
Brooks, Bernard R.
Text and Data Mining valid from 2018-08-20
Article History
Received: 1 June 2018
Accepted: 9 August 2018
First Online: 20 August 2018