Re: [gmx-users] Molecular volume

I think in 3.3, there was a new option added to g_sas that allows you to calculate the solvent accessible volume, which may be what you want. Try searching the list. David On 11/6/06, Mohan Boggara <[EMAIL PROTECTED]> wrote: Dear users, Is there a way to calculate molecular volume of small sol

[gmx-users] Molecular volume

Dear users, Is there a way to calculate molecular volume of small solutes that we use in simulations?Mohan -- Mohan BoggaraGraduate Research AssistantDept of Chemical Engineering University of HoustonS222 Engg Bldg 1, 4800 Calhoun Rd,Houston, Texas-77204, USAMobile: 1-832-643-5729Office: 1-713-743-