Evaluation of log P, pKa, and log D predictions from the SAMPL7 blind challenge
Computational Chemistry Daily,
link.springer.com - The Statistical Assessment of Modeling of Proteins and Ligands (SAMPL) challenges focuses the computational…
link.springer.com - The Statistical Assessment of Modeling of Proteins and Ligands (SAMPL) challenges focuses the computational…
link.springer.com - A variety of fields would benefit from accurate \(pK_a\) predictions, especially drug design due to the…