CHARMM Development Project Forums User Discussion & Questions Parameter Set Discussion

Thread Title Replies Views Last Post IMPORTANT NOTE FOR UNREGISTERED USERS by tim 12/30/13 02:42 PM tim Replies: 0 Views: 25,154 0 25,154 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: 33,056 0 33,056 05/28/12 09:54 PM by rmv Announcement: lsfitpar program by Kenno 06/08/15 10:53 PM Kenno Replies: 1 Views: 3,123 1 3,123 06/08/15 10:53 PM by Kenno ParamChem: Automation of CGenFF by alex 04/20/15 06:53 PM Kenno Replies: 9 Views: 36,978 9 36,978 04/20/15 06:53 PM by Kenno Charmm General Force Field (CGenFF) download link 12all by Kenno 04/20/15 06:53 PM Kenno Replies: 13 Views: 67,152 13 67,152 04/20/15 06:53 PM by Kenno CHARMM36 additive force field release by alex 09/01/14 10:48 PM alex Replies: 4 Views: 17,257 4 17,257 09/01/14 10:48 PM by alex READ THIS FIRST: guidelines for Parameter Set Disc by Kenno 10/03/13 06:24 PM fiona Replies: 1 Views: 11,232 1 11,232 10/03/13 06:24 PM by fiona Conversion of OPLS ITP file to charmm/gromacs itp file by yogesh 02/25/21 08:05 PM rmv Replies: 2 Views: 286 2 286 02/25/21 08:05 PM by rmv units for the dihedral force constants by kwaldner 02/19/21 03:41 PM lennart Replies: 1 Views: 118 1 118 02/19/21 03:41 PM by lennart how much should I scan an aromatic dihedral? by kwaldner 02/18/21 03:09 PM kwaldner Replies: 2 Views: 175 2 175 02/18/21 03:09 PM by kwaldner Compatibility of Charmm22 Parameters in Charmm36 by akash 02/05/21 06:54 PM akash Replies: 6 Views: 352 6 352 02/05/21 06:54 PM by akash dihedral scan for fused ring system by kwaldner 02/03/21 06:07 PM kwaldner Replies: 0 Views: 81 0 81 02/03/21 06:07 PM by kwaldner Parameterizing Borate cages by AbhiAcharya 12/25/20 09:03 PM AbhiAcharya Replies: 0 Views: 115 0 115 12/25/20 09:03 PM by AbhiAcharya Group definition for organic molecule by lin1209 12/17/20 02:29 PM rmv Replies: 1 Views: 151 1 151 12/17/20 02:29 PM by rmv Connecting a linker to Lys by Nir99 08/30/20 04:53 PM rmv Replies: 1 Views: 373 1 373 08/30/20 04:53 PM by rmv toppar files for GTP-gamma S 12all by AnnaBkmn 08/12/20 01:38 PM AnnaBkmn Replies: 10 Views: 1,352 10 1,352 08/12/20 01:38 PM by AnnaBkmn CHARMM parameters for Mn2+ by Abhishek.2015 08/01/20 08:45 AM Corey Taylor Replies: 7 Views: 1,585 7 1,585 08/01/20 08:45 AM by Corey Taylor

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