piwheels

rdkit-to-params

Create or modify Rosetta params files (topology files) from scratch, RDKit mols or another params file.

Installation

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

pip3 install rdkit-to-params

Dependencies

• rdkit

Releases

Version	Released	Bookworm Python 3.11	Trixie Python 3.13	Files
1.3.9	2026-03-30
rdkit_to_params-1.3.9-py3-none-any.whl (64 KB)
1.3.8	2026-03-16
rdkit_to_params-1.3.8-py3-none-any.whl (64 KB)
1.3.7	2026-03-16
rdkit_to_params-1.3.7-py3-none-any.whl (64 KB)
1.3.6	2026-03-16
rdkit_to_params-1.3.6-py3-none-any.whl (63 KB)
1.3.4	2026-02-28
rdkit_to_params-1.3.4-py3-none-any.whl (58 KB)
1.3.3	2026-01-03
rdkit_to_params-1.3.3-py3-none-any.whl (55 KB)
1.3.2	2025-12-31
rdkit_to_params-1.3.2-py3-none-any.whl (54 KB)
1.3.0	2025-11-28
rdkit_to_params-1.3.0-py3-none-any.whl (51 KB)
1.2.14	2025-11-16
rdkit_to_params-1.2.14-py3-none-any.whl (50 KB)
1.2.13	2025-11-16
rdkit_to_params-1.2.13-py3-none-any.whl (49 KB)
1.2.12	2025-11-16
rdkit_to_params-1.2.12-py3-none-any.whl (28 KB)
1.2.11	2025-07-15
1.2.10	2025-07-15
1.2.8	2023-12-08
rdkit_to_params-1.2.8-py3-none-any.whl (49 KB)
1.2.5	2023-07-19
rdkit_to_params-1.2.5-py3-none-any.whl (48 KB)
1.2.4	2023-05-21
rdkit_to_params-1.2.4-py3-none-any.whl (48 KB)
1.2.3	2023-01-09
rdkit_to_params-1.2.3-py3-none-any.whl (48 KB)
1.2.2	2022-06-09
rdkit_to_params-1.2.2-py3-none-any.whl (48 KB)
1.2.1	2022-05-25
rdkit_to_params-1.2.1-py3-none-any.whl (48 KB)
1.2	2022-04-08
rdkit_to_params-1.2-py3-none-any.whl (46 KB)
1.1.14	2021-10-17
rdkit_to_params-1.1.14-py3-none-any.whl (44 KB)
1.1.13	2021-10-01
rdkit_to_params-1.1.13-py3-none-any.whl (44 KB)
1.1.12	2021-09-27
rdkit_to_params-1.1.12-py3-none-any.whl (44 KB)
1.1.11	2021-09-22
rdkit_to_params-1.1.11-py3-none-any.whl (43 KB)
1.1.10	2021-09-21
rdkit_to_params-1.1.10-py3-none-any.whl (43 KB)
1.1.9	2021-09-21
rdkit_to_params-1.1.9-py3-none-any.whl (43 KB)
1.1.8	2021-06-16
rdkit_to_params-1.1.8-py3-none-any.whl (42 KB)
1.1.7	2021-05-28
rdkit_to_params-1.1.7-py3-none-any.whl (42 KB)
1.1.6	2021-03-22
rdkit_to_params-1.1.6-py3-none-any.whl (42 KB)
1.1.5	2021-02-18
rdkit_to_params-1.1.5-py3-none-any.whl (41 KB)
1.1.5b0 pre-release	2021-03-13
rdkit_to_params-1.1.5b0-py3-none-any.whl (41 KB)
1.1.4	2021-01-02
rdkit_to_params-1.1.4-py3-none-any.whl (40 KB)
1.1.4b0 pre-release	2021-01-29
rdkit_to_params-1.1.4b0-py3-none-any.whl (24 KB)
1.1.3	2020-11-05
rdkit_to_params-1.1.3-py3-none-any.whl (38 KB)
1.1.2	2020-07-21
rdkit_to_params-1.1.2-py3-none-any.whl (37 KB)
1.1.1	2020-07-16
rdkit_to_params-1.1.1-py3-none-any.whl (37 KB)
1.1.0	2020-07-16
rdkit_to_params-1.1.0-py3-none-any.whl (37 KB)
1.0.5	2020-07-10
rdkit_to_params-1.0.5-py3-none-any.whl (21 KB)
1.0.4	2020-07-02
rdkit_to_params-1.0.4-py3-none-any.whl (21 KB)
1.0.2	2020-06-03
rdkit_to_params-1.0.2-py3-none-any.whl (30 KB)
1.0.1	2020-06-02
1	2020-06-02
rdkit_to_params-1-py3-none-any.whl (26 KB)

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