PyRx - Virtual Screening Tool Discussion

Virtual Screening software for Computational Drug Discovery

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error with pyrx 1.1_error local variable 'targetName' referenced befo... By faizah fulyani on Wed Jul 16, 2025 07:23 AM	5	31	By Sarkis Dallakian on Thu Jul 17, 2025 03:16 PM
Update of version 1.1 to 1.2? By Stephen Haines on Wed Jun 11, 2025 04:10 AM	3	44	By faizah fulyani on Wed Jul 16, 2025 04:13 AM
C:\Program Files (x86)\The Scripps Research Institute\Autodock\4.2.6\... By Martin KIENDREBEOGO on Mon Jul 14, 2025 09:41 PM	1	11	By Martin KIENDREBEOGO on Mon Jul 14, 2025 09:41 PM
软件报错 By 姜小白 on Thu Jul 10, 2025 12:38 PM	1	9	By 姜小白 on Thu Jul 10, 2025 12:38 PM
Bug reported in PyRx 1.1 log (which doesn't prevent docking with Vina) By Stephen Haines on Wed Jun 11, 2025 04:07 AM	5	40	By Sarkis Dallakian on Wed Jun 25, 2025 10:31 PM
How to increase number of docking poses By Akanksha on Sun Apr 06, 2025 01:21 PM	6	85	By Sarkis Dallakian on Mon May 05, 2025 01:56 PM
Issue with using PyRx software "error: insufficient memory" By Bhrundha K on Wed Apr 09, 2025 06:59 AM	6	131	By Sarkis Dallakian on Sun May 04, 2025 05:26 PM
Purchase of Software By Mahesha Gangadhariah on Fri Jan 21, 2022 12:38 PM	23	252	By Sarkis Dallakian on Wed Mar 05, 2025 12:00 AM
64 bit macintosh version? By Blake Peterson on Fri Feb 07, 2025 12:39 AM	2	96	By Sarkis Dallakian on Fri Feb 07, 2025 12:45 AM
PyRx-0.9.2-linux-x86_64 on CentOS Stream 9 By Flavio Augusto Vicente Seixas on Wed Aug 07, 2024 09:05 PM	10	280	By Sarkis Dallakian on Thu Jan 30, 2025 12:58 AM
update it to version 1.1 By Tuncay Karakurt on Thu Jan 09, 2025 02:19 PM	6	187	By Omar Attraqchi on Mon Jan 27, 2025 01:44 PM
Import metal ions as ligands By Piyush Kumar on Sun Jan 26, 2025 11:24 PM	2	44	By Omar Attraqchi on Mon Jan 27, 2025 04:44 AM
Problem with Pyrx v8 By Abu Hurayra Emad on Thu Dec 26, 2024 05:11 PM	2	55	By Sarkis Dallakian on Fri Dec 27, 2024 01:24 AM
Running PyRx on local cluster By Abhishek Chowdhury on Fri Oct 04, 2024 12:24 PM	2	93	By Sarkis Dallakian on Sat Oct 05, 2024 07:37 PM
Segmentation fault - PyRx By Koby Spiegel on Wed Sep 18, 2024 06:14 PM	2	56	By Sarkis Dallakian on Fri Sep 20, 2024 01:01 AM
Update to use recent versions of Vina and Autodock in PyRx? By Stephen Haines on Wed Sep 04, 2024 04:23 AM	5	224	By Stephen Haines on Thu Sep 05, 2024 01:34 AM
Can't run Windows PyRx 1.0 because Windows Script Host has been disab... By Stephen Haines on Wed Sep 04, 2024 03:27 AM	4	101	By Sarkis Dallakian on Wed Sep 04, 2024 04:11 AM
Error in PyRx By Eduardo Borges de Melo on Wed Aug 21, 2024 09:51 PM	3	81	By Sarkis Dallakian on Sat Aug 24, 2024 08:33 PM
pyrx error on windows machine By Dhrubajyoti Maji on Tue Jun 18, 2024 09:33 AM	1	227	By Dhrubajyoti Maji on Tue Jun 18, 2024 09:33 AM
PyRx Audtodock 4 By Isak Lalnunpuia on Mon Jun 17, 2024 04:20 PM	1	68	By Isak Lalnunpuia on Mon Jun 17, 2024 04:20 PM
Query about protein preparation in PyRx By Ruina on Fri May 03, 2024 12:23 PM	7	141	By Ruina on Mon May 13, 2024 10:20 AM
Running PyRx on Mac By David Chu on Sun Dec 17, 2023 03:43 AM	1	237	By David Chu on Sun Dec 17, 2023 03:43 AM
Plotting Graph in pyrx By Sayan on Thu Dec 14, 2023 03:12 PM	2	78	By Sayan on Thu Dec 14, 2023 03:13 PM
Query regarding software version By NEHA GUPTA on Mon Dec 04, 2023 06:25 AM	2	94	By Sarkis Dallakian on Sun Dec 10, 2023 11:49 PM
Dockamon By Jacek Plewka on Tue Nov 21, 2023 11:59 AM	2	119	By Sarkis Dallakian on Fri Nov 24, 2023 06:56 AM

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