Hi Vitaly-- > > Thank you, it's working well! Just to clarify, is this potential meant > to replace 'VDW' (as in your JMR 2014 paper), or to be used in > conjunction with it? >
The term now replaces VDW and ELEC. The current setup in eginput/eefx now reflects this. Hopefully, the supporting paper will be out soon... Charles _______________________________________________ Xplor-nih mailing list [email protected] https://dcb.cit.nih.gov/mailman/listinfo/xplor-nih
