piwheels

mopac-step

A SEAMM plug-in to setup, run and analyze semiempirical calculations with MOPAC

Installation

In a virtualenv (see these instructions if you need to create one):

pip3 install mopac-step

Dependencies

• requests
• tabulate
• seamm
• py-cpuinfo
• molsystem

Releases

Version	Released	Bullseye Python 3.9	Bookworm Python 3.11	Trixie Python 3.13	Files
2025.12.21	2025-12-21
mopac_step-2025.12.21-py2.py3-none-any.whl (89 KB)
2025.12.20	2025-12-20
mopac_step-2025.12.20-py2.py3-none-any.whl (88 KB)
2025.10.22	2025-10-22
mopac_step-2025.10.22-py2.py3-none-any.whl (86 KB)
2025.5.7.1	2025-05-07
mopac_step-2025.5.7.1-py2.py3-none-any.whl (86 KB)
2025.5.7	2025-05-07
mopac_step-2025.5.7-py2.py3-none-any.whl (86 KB)
2025.3.6	2025-03-06
mopac_step-2025.3.6-py2.py3-none-any.whl (86 KB)
2025.2.23	2025-02-24
mopac_step-2025.2.23-py2.py3-none-any.whl (86 KB)
2024.12.9	2024-12-09
mopac_step-2024.12.9-py2.py3-none-any.whl (86 KB)
2024.10.15	2024-10-15
mopac_step-2024.10.15-py2.py3-none-any.whl (85 KB)
2024.8.21	2024-08-21
mopac_step-2024.8.21-py2.py3-none-any.whl (85 KB)
2024.8.17	2024-08-17
mopac_step-2024.8.17-py2.py3-none-any.whl (85 KB)
2024.7.29	2024-07-29
mopac_step-2024.7.29-py2.py3-none-any.whl (83 KB)
2024.5.14.2	2024-05-14
mopac_step-2024.5.14.2-py2.py3-none-any.whl (83 KB)
2024.5.14.1	2024-05-14
mopac_step-2024.5.14.1-py2.py3-none-any.whl (83 KB)
2024.5.14	2024-05-14
mopac_step-2024.5.14-py2.py3-none-any.whl (83 KB)
2024.3.17	2024-03-17
mopac_step-2024.3.17-py2.py3-none-any.whl (83 KB)
2024.2.24	2025-02-24
mopac_step-2024.2.24-py2.py3-none-any.whl (86 KB)
2024.2.10.1	2024-02-10
mopac_step-2024.2.10.1-py2.py3-none-any.whl (82 KB)
2024.2.10	2024-02-10
mopac_step-2024.2.10-py2.py3-none-any.whl (82 KB)
2024.2.9.2	2024-02-09
mopac_step-2024.2.9.2-py2.py3-none-any.whl (81 KB)
2024.2.9.1	2024-02-09
mopac_step-2024.2.9.1-py2.py3-none-any.whl (81 KB)
2024.2.9	2024-02-09
mopac_step-2024.2.9-py2.py3-none-any.whl (81 KB)
2024.2.8	2024-02-09
mopac_step-2024.2.8-py2.py3-none-any.whl (81 KB)
2023.12.18	2023-12-18
mopac_step-2023.12.18-py2.py3-none-any.whl (80 KB)
2023.11.15	2023-11-15
mopac_step-2023.11.15-py2.py3-none-any.whl (79 KB)
2023.11.14	2023-11-15
mopac_step-2023.11.14-py2.py3-none-any.whl (79 KB)
2023.10.30	2023-10-30
mopac_step-2023.10.30-py2.py3-none-any.whl (79 KB)
2023.8.30	2023-08-30
mopac_step-2023.8.30-py2.py3-none-any.whl (79 KB)
2023.7.27	2023-07-28
mopac_step-2023.7.27-py2.py3-none-any.whl (79 KB)
2023.7.26	2023-07-26
mopac_step-2023.7.26-py2.py3-none-any.whl (79 KB)
2023.7.24	2023-07-25
mopac_step-2023.7.24-py2.py3-none-any.whl (78 KB)
2023.6.5	2023-06-05
mopac_step-2023.6.5-py2.py3-none-any.whl (78 KB)
2023.4.24	2023-04-24
mopac_step-2023.4.24-py2.py3-none-any.whl (78 KB)
2023.3.31.1	2023-03-31
mopac_step-2023.3.31.1-py2.py3-none-any.whl (78 KB)
2023.3.31	2023-03-31
mopac_step-2023.3.31-py2.py3-none-any.whl (77 KB)
2023.2.13	2023-02-13
mopac_step-2023.2.13-py2.py3-none-any.whl (77 KB)
2022.11.18	2022-11-18
mopac_step-2022.11.18-py2.py3-none-any.whl (69 KB)
2022.11.4	2022-11-04
mopac_step-2022.11.4-py2.py3-none-any.whl (69 KB)
2022.10.20	2022-10-20
mopac_step-2022.10.20-py2.py3-none-any.whl (62 KB)
2022.8.17	2022-08-17
mopac_step-2022.8.17-py2.py3-none-any.whl (61 KB)
2022.5.23	2022-05-23
mopac_step-2022.5.23-py2.py3-none-any.whl (62 KB)
2022.3.13.1	2022-03-14
mopac_step-2022.3.13.1-py2.py3-none-any.whl (59 KB)
2022.3.13	2022-03-14
mopac_step-2022.3.13-py2.py3-none-any.whl (59 KB)
2022.3.13rc1 pre-release	2022-03-14
mopac_step-2022.3.13rc1-py2.py3-none-any.whl (59 KB)
2022.3.1	2022-03-02
mopac_step-2022.3.1-py2.py3-none-any.whl (55 KB)
2022.1.13	2022-01-14
mopac_step-2022.1.13-py2.py3-none-any.whl (55 KB)
2021.10.25	2021-10-25
2021.9.16	2021-09-17
2021.6.3	2021-06-04
mopac_step-2021.6.3-py2.py3-none-any.whl (48 KB)
2021.2.11	2021-02-11
mopac_step-2021.2.11-py2.py3-none-any.whl (48 KB)
2021.2.4	2021-02-04
mopac_step-2021.2.4-py2.py3-none-any.whl (47 KB)
2020.12.5	2020-12-05
mopac_step-2020.12.5-py2.py3-none-any.whl (47 KB)
2020.9.29	2020-09-29
mopac_step-2020.9.29-py2.py3-none-any.whl (46 KB)
2020.8.1	2020-08-01
mopac_step-2020.8.1-py2.py3-none-any.whl (46 KB)
2020.7.0	2020-07-23
mopac_step-2020.7.0-py2.py3-none-any.whl (46 KB)
2010.10.7	2020-10-07
mopac_step-2010.10.7-py2.py3-none-any.whl (46 KB)
0.9	2020-04-15
mopac_step-0.9-py2.py3-none-any.whl (45 KB)
0.8.0	2020-01-25
mopac_step-0.8.0-py2.py3-none-any.whl (45 KB)
0.7.0	2019-12-17
mopac_step-0.7.0-py2.py3-none-any.whl (37 KB)
0.6	2019-09-13
mopac_step-0.6-py2.py3-none-any.whl (38 KB)
0.5.1	2019-08-30
mopac_step-0.5.1-py2.py3-none-any.whl (37 KB)
0.5.0	2019-08-29
mopac_step-0.5.0-py2.py3-none-any.whl (36 KB)
0.2.2	2019-08-13
mopac_step-0.2.2-py2.py3-none-any.whl (36 KB)
0.2.1	2019-08-13
mopac_step-0.2.1-py2.py3-none-any.whl (36 KB)
0.2.0	2019-08-13
mopac_step-0.2.0-py2.py3-none-any.whl (36 KB)

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