Re: [gmx-users] No topology

2006-06-10 Thread David van der Spoel
Edgar Mixcoha Hernández wrote: I just want to generate the topology of one protein with water. Previously I had obtained the archive .gro from a .pdb, I used editconf to make a box after I used genbox to add waters to protein. The archive .gro is generated but I have tried many times and with o

[gmx-users] No topology

2006-06-10 Thread Edgar Mixcoha Hernández
Title: No topology I just want to generate the topology of one protein with water. Previously I had obtained the archive .gro from a .pdb, I used editconf to make a box after I used genbox to add waters to protein. The archive .gro is generated but I have tried many times and with other proteins