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: 24,022 0 24,022 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: 31,872 0 31,872 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: 101,402 33 101,402 11/20/17 10:39 PM by rmv Controling White Space by hlwood 03/04/05 07:24 PM hlwood Replies: 3 Views: 12,053 3 12,053 03/04/05 07:24 PM by hlwood lipid C-D order parameters using CORREL 123456all by rmv 07/05/20 07:14 PM lqz Replies: 52 Views: 83,454 52 83,454 07/05/20 07:14 PM by lqz hbonds.inp 123456all by lennart 06/25/20 11:23 AM lennart Replies: 50 Views: 108,471 50 108,471 06/25/20 11:23 AM by lennart applying crystal symmetry by rmv 12/02/19 09:45 PM rmv Replies: 7 Views: 8,973 7 8,973 12/02/19 09:45 PM by rmv read-watbox.str by lennart 03/21/19 01:39 PM tyrion_jj Replies: 9 Views: 6,020 9 6,020 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: 2,479 4 2,479 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: 28,154 15 28,154 06/12/18 02:44 PM by lennart rmsf calculation by abir 05/23/18 01:48 PM abir Replies: 2 Views: 1,633 2 1,633 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: 4,392 9 4,392 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: 2,746 3 2,746 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: 1,142 0 1,142 12/31/16 06:35 AM by Hem@1

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