Addition to "Scaffold Hopping and Optimization of Small Molecule Soluble Adenyl Cyclase Inhibitors Led by Free Energy Perturbation".
Shan SunMakoto FushimiThomas RossettiNavpreet KaurJacob FerreiraMichael MillerJonathan QuastJoop van den HeuvelClemens SteegbornLonny R LevinJochen BuckRobert W MyersStacia KargmanNigel LivertonPeter T MeinkeDavid J HugginsPublished in: Journal of chemical information and modeling (2024)