smina Discussion

Scoring and Minimization with AutoDock Vina

Status: Beta

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Topic	Posts	Views	Last Post
help fixing an open Babel warning in Smina By Faustina Nyarko on Mon Dec 09, 2019 08:05 PM	2	380	By David Koes on Mon Dec 09, 2019 08:44 PM
Atom Mappings and Threonine Hydrogens By Hao Shen on Mon Dec 02, 2019 07:56 PM	6	617	By Hao Shen on Tue Dec 03, 2019 03:21 PM
Problem with Compilation By Matthew Fisher on Thu Nov 28, 2019 01:40 PM	2	343	By David Koes on Sat Nov 30, 2019 04:30 PM
Understanding Minimize Results By Hao Shen on Wed Nov 20, 2019 10:47 PM	6	1006	By Hao Shen on Thu Nov 21, 2019 09:03 PM
Minimize Specifics By Hao Shen on Mon Nov 18, 2019 09:25 PM	3	295	By Hao Shen on Tue Nov 19, 2019 05:37 PM
installation issue molgetter By RJ on Sun Nov 10, 2019 06:21 PM	1	206	By RJ on Sun Nov 10, 2019 06:21 PM
ad4 scoring in smina By Bakary N'tji Diallo on Mon Oct 21, 2019 09:57 AM	3	506	By Bakary N'tji Diallo on Mon Oct 21, 2019 11:49 AM
Smina.GPU stuck in Analyzing the binding site / cache::populate By ZhenyOK on Sun May 22, 2016 06:02 PM	5	1048	By David Koes on Sun Sep 29, 2019 07:34 PM
Compiling static version of smina By schrodinger83 on Sun Sep 15, 2019 11:48 PM	2	432	By David Koes on Tue Sep 17, 2019 01:06 PM
Problem with multi-model output PDB By Hans Senn on Thu Aug 22, 2019 11:56 AM	5	636	By David Koes on Thu Aug 22, 2019 06:52 PM
different docking poses from different input type By Thomas Evangelidis on Mon Jun 03, 2019 10:36 AM	4	1882	By David Koes on Thu Jun 06, 2019 09:44 PM
steps to compile? By Bakary N'tji Diallo on Mon Apr 08, 2019 12:10 PM	5	652	By David Koes on Mon Apr 08, 2019 07:28 PM
compiling with Intel compiler By Ho Leung Ng on Wed Apr 03, 2019 12:05 AM	3	209	By Ho Leung Ng on Wed Apr 03, 2019 09:06 PM
No residue information on minimized PDBQT By Miro on Mon Mar 28, 2016 12:00 PM	19	1948	By c4asma on Fri Mar 08, 2019 12:43 PM
RMSD Parameters in Smina By Michael Carter on Fri Feb 08, 2019 11:05 AM	3	415	By Michael Carter on Wed Feb 13, 2019 10:44 AM
Pair-wise interaction terms By Matthew H Bakalar on Mon Jan 14, 2019 04:24 PM	7	718	By David Koes on Thu Jan 24, 2019 06:49 PM
Water and cofactors minimisation By Miro on Mon Dec 24, 2018 10:19 AM	3	348	By Miro on Tue Dec 25, 2018 05:47 AM
user_grid By Ivan Felsztyna on Wed Jun 13, 2018 01:17 PM	2	554	By David Koes on Tue Jun 19, 2018 04:42 PM
cannot compile smina in Cygwin By Hiroshi Nikaido on Thu Aug 03, 2017 08:19 PM	10	611	By David Koes on Wed Aug 09, 2017 01:42 AM
Minimization problem By Manuel Llanos on Wed May 17, 2017 10:55 PM	2	813	By David Koes on Thu May 18, 2017 01:45 AM
Smina not linking to Openbabel By Jernej Zidar on Wed Oct 12, 2016 07:02 AM	3	598	By Jernej Zidar on Fri Oct 14, 2016 07:07 AM
Possible bug parsing PDBQT file By Miro on Wed May 04, 2016 10:38 AM	13	1133	By ZhenyOK on Sun May 22, 2016 07:47 PM
Compiling smina in old server By Miro on Mon Apr 04, 2016 08:29 AM	4	692	By Miro on Mon Apr 04, 2016 01:12 PM
OSX By Alessio on Sat Mar 05, 2016 01:41 PM	2	584	By David Koes on Sat Mar 05, 2016 02:04 PM
Problems to compile smina from scratch By Jesus Seco on Wed Jul 12, 2017 06:50 AM	1	394	By Jesus Seco on Wed Jul 12, 2017 06:50 AM

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