[gmx-users] Re: Active Site

[Wei Fu]

Hi, Marc,

    I am very intersted in your program, which can automaticlly calculate the volume with simulation time, although you think it is rough. In addition, could you please tell the algorithm, for instance, how do you define the accessible surface? Thanks.

Best,
 
                Wei

                2005-03-29


  Wei Fu (Linda)
  Postdoctoral Research Associate
  Department of Biology and Biochemistry 
  University of Houston
  4800 Calhoun Rd. HSC #402C
  Houston, TX 77204-5001   USA
  Phone:713-743-8355(o)  713-741-6388(h) 
  Fax:713-743-8351 
  Email: fuwei at adrik.bchs.uh.edu
  http://adrik.bchs.uh.edu/~fuwei/