[Aspuru-Guzik group list] [Aspuru-meetings-list] group meeting tomorrow: Adrian Jinich

Hi Everyone, Tomorrow Adrian will be giving group meeting. We'll meet at 2pm in the Division Room. Adrian's talk title and abstract is included below. ====================================================== Quantum chemical estimates of metabolic Gibbs reaction energies ====================================================== In the field of systems biology, estimates of Gibbs reaction energies of metabolic reactions are extremely useful. They are routinely used to model cellular metabolism and to engineering synthetic pathways for production of useful compounds. However, current sources of data - experimental values and Group Contribution Methods - suffer from several disadvantages. I will discuss the progress we've made towards implementing robust and cost-efficient methods to estimate deltaG's with computational quantum chemistry. -- Ryan Babbush | PhD Student in Physics (949) 331-3943 | babbush(a)fas.harvard.edu Harvard University | Aspuru-Guzik Group 12 Oxford Street | Cambridge, MA 02138 _______________________________________________ Aspuru-meetings-list mailing list Aspuru-meetings-list(a)lists.fas.harvard.edu https://lists.fas.harvard.edu/mailman/listinfo/aspuru-meetings-list