pKa calculations for tautomerizable and conformationally flexible molecules: partition function vs. state transition approach
Crossref DOI link: https://doi.org/10.1007/s00894-019-4033-4
Published Online: 2019-04-30
Published Print: 2019-05
Update policy: https://doi.org/10.1007/springer_crossmark_policy
Tielker, Nicolas
Eberlein, Lukas
Chodun, Christian
Güssregen, Stefan
Kast, Stefan M. http://orcid.org/0000-0001-7346-7064
Text and Data Mining valid from 2019-04-30
Article History
Received: 17 February 2019
Accepted: 7 April 2019
First Online: 30 April 2019