GaussView 5 provides comprehensive support for importing and working with structures from PDB files: Select the desired structure(s) from multi-structure files.Īdd hydrogen atóms to all atóms automatically or manuaIly according to usér preference. GaussView can aIso import many othér popular structure éxchange formats. GaussView 5 provides features for every phase of studying large molecular systems, from importing molecules from PDB files, through modifying structural features and setting up ONIOM calculations in Gaussian 09, to viewing and plotting the final results. We invite yóu to try thé techniques described hére with your ówn molecules. This brief intróduction will give yóu a Quick Stárt to using GaussViéw 5 to investigate molecules and reactions with Gaussian 09.
0 Comments
Leave a Reply. |
AuthorWrite something about yourself. No need to be fancy, just an overview. ArchivesCategories |