From owner-chemistry@ccl.net Sat Mar 23 15:17:00 2024 From: "Mark Nicholas Jones mark:-:mqs.dk" To: CCL Subject: CCL: Arm processor based High-performance COSMO Container Message-Id: <-55116-240323151537-32534-vz28mc8t3INLdLqPHTa/4w _ server.ccl.net> X-Original-From: "Mark Nicholas Jones" Date: Sat, 23 Mar 2024 15:15:30 -0400 Sent to CCL by: "Mark Nicholas Jones" [mark . mqs.dk] At Molecular Quantum Solutions (MQS) we have developed a high performance implementation of the COSMO model running on Arm processors to generate in a energy and cost efficient way COSMO and sigma-profiles data. See the following blog post: https://blog.mqs.dk/posts/10_cosmo/10_cosmo/ Please let us know if you are interested in testing the container for a two weeks trial to see if it provides valuable data for your use-cases: contact * mqs.dk