CHARMM Development Project Forums CHARMM Community Script Archive

Thread Title Replies Views Last Post IMPORTANT NOTE FOR UNREGISTERED USERS by tim 12/30/13 02:42 PM tim Replies: 0 Views: 20,670 0 20,670 12/30/13 02:42 PM by tim READ BEFORE POSTING; updated March 2016 by rmv 05/28/12 09:54 PM rmv Replies: 0 Views: 28,383 0 28,383 05/28/12 09:54 PM by rmv Sample scripts for basic tasks in CHARMM 1234all by lennart 11/20/17 10:39 PM rmv Replies: 33 Views: 91,446 33 91,446 11/20/17 10:39 PM by rmv Controling White Space by hlwood 03/04/05 07:24 PM hlwood Replies: 3 Views: 11,367 3 11,367 03/04/05 07:24 PM by hlwood applying crystal symmetry by rmv 12/02/19 09:45 PM rmv Replies: 7 Views: 7,554 7 7,554 12/02/19 09:45 PM by rmv read-watbox.str by lennart 03/21/19 01:39 PM tyrion_jj Replies: 9 Views: 4,533 9 4,533 03/21/19 01:39 PM by tyrion_jj checking for water transits by rmv 10/25/18 09:59 PM rmv Replies: 4 Views: 1,586 4 1,586 10/25/18 09:59 PM by rmv self-diffusion-coeff.inp 12all by lennart 06/12/18 02:44 PM lennart Replies: 15 Views: 24,763 15 24,763 06/12/18 02:44 PM by lennart rmsf calculation by abir 05/23/18 01:48 PM abir Replies: 2 Views: 1,063 2 1,063 05/23/18 01:48 PM by abir PDB with 2 segid WZ1 and WZ2 cannot read to create psf by Rohit 11/24/17 06:58 AM lennart Replies: 9 Views: 2,819 9 2,819 11/24/17 06:58 AM by lennart Charmm c40b1 g09 interface qm/mm script by jacquez88 03/09/17 03:33 PM jacquez88 Replies: 3 Views: 2,035 3 2,035 03/09/17 03:33 PM by jacquez88 implicit solvent for Acetonitrile by Hem@1 12/31/16 06:35 AM Hem@1 Replies: 0 Views: 906 0 906 12/31/16 06:35 AM by Hem@1 Force field transformation from Gromacs to Charmm by Dawid 12/30/16 06:27 PM lennart Replies: 3 Views: 2,321 3 2,321 12/30/16 06:27 PM by lennart filling a box by placing molecules on a grid by rmv 10/15/15 08:01 PM fairoos Replies: 9 Views: 10,600 9 10,600 10/15/15 08:01 PM by fairoos

Category Display Options Show From Previous  1 Day 2 Days 1 Week 2 Weeks 3 Weeks 1 Month 3 Months 6 Months 1 Year All Threads   Sort by  Last Post Time Created Time Thread Title Replies Starter Views   Ascending Descending