openff-bespokefit
Automated tools for the generation of bespoke SMIRNOFF format parameters for individual molecules.
Automated tools for the generation of bespoke SMIRNOFF format parameters for individual molecules.
| Name | Type | Version | Platform | Labels | Updated | Size | Downloads | Actions |
|---|
noarch/openff-bespokefit-0.4.3-pyhd8ed1ab_0.conda | conda | 0.4.3 | noarch | main | May 15, 2025, 07:31 PM | 141.35 KB | 4.4K | |
noarch/openff-bespokefit-0.4.2-pyhd8ed1ab_0.conda | conda | 0.4.2 | noarch | main | Mar 12, 2025, 09:47 PM | 140.73 KB | 1.7K | |
noarch/openff-bespokefit-0.4.1-pyhd8ed1ab_1.conda | conda | 0.4.1 | noarch | main | Jan 7, 2025, 08:29 PM | 140.84 KB | 1.4K | |
noarch/openff-bespokefit-0.4.1-pyhd8ed1ab_0.conda | conda | 0.4.1 | noarch | main | Nov 7, 2024, 08:40 PM | 140.6 KB | 1.3K | |
noarch/openff-bespokefit-0.4.0-pyhd8ed1ab_0.conda | conda | 0.4.0 | noarch | main | Oct 2, 2024, 11:30 PM | 140.86 KB | 1.2K | |
noarch/openff-bespokefit-0.3.0-pyhd8ed1ab_0.conda | conda | 0.3.0 | noarch | main | Mar 27, 2024, 08:42 PM | 139.49 KB | 1.4K | |
noarch/openff-bespokefit-0.2.3-pyhd8ed1ab_1.conda | conda | 0.2.3 | noarch | main | Feb 17, 2024, 09:29 PM | 137.84 KB | 1.5K | |
noarch/openff-bespokefit-0.2.3-pyhd8ed1ab_0.conda | conda | 0.2.3 | noarch | main | Nov 15, 2023, 04:50 PM | 138.43 KB | 1.4K | |
noarch/openff-bespokefit-0.2.2-pyhd8ed1ab_5.conda | conda | 0.2.2 | noarch | main | Jul 10, 2023, 03:24 PM | 135.54 KB | 2.5K | |
noarch/openff-bespokefit-0.2.2-pyhd8ed1ab_1.conda | conda | 0.2.2 | noarch | main | Jul 5, 2023, 04:30 PM | 137.16 KB | 1.5K | |
noarch/openff-bespokefit-0.2.2-pyhd8ed1ab_0.conda | conda | 0.2.2 | noarch | main | May 8, 2023, 12:42 PM | 136.3 KB | 1.8K | |
noarch/openff-bespokefit-0.2.1-pyhd8ed1ab_0.conda | conda | 0.2.1 | noarch | main | Apr 5, 2023, 01:37 AM | 136.27 KB | 1.7K | |
noarch/openff-bespokefit-0.1.3-pyhd8ed1ab_3.conda | conda | 0.1.3 | noarch | main | Feb 3, 2023, 05:40 PM | 134.33 KB | 1.9K | |
noarch/openff-bespokefit-0.1.3-pyhd8ed1ab_2.conda | conda | 0.1.3 | noarch | main | Jan 19, 2023, 03:01 PM | 134.23 KB | 1.8K | |
noarch/openff-bespokefit-0.2.0-pyhd8ed1ab_1.conda | conda | 0.2.0 | noarch | mainbroken | Jan 6, 2023, 03:30 PM | 134.39 KB | 288 | |
noarch/openff-bespokefit-0.2.0-pyhd8ed1ab_0.conda | conda | 0.2.0 | noarch | mainbroken | Dec 13, 2022, 07:54 PM | 134.02 KB | 296 | |
noarch/openff-bespokefit-0.1.3-pyhd8ed1ab_0.conda | conda | 0.1.3 | noarch | main | Nov 23, 2022, 07:15 PM | 129.59 KB | 1.9K | |
noarch/openff-bespokefit-0.1.2-pyhd8ed1ab_1.tar.bz2 | conda | 0.1.2 | noarch | main | Nov 16, 2022, 02:26 AM | 126.01 KB | 1.8K | |
noarch/openff-bespokefit-0.1.2-pyhd8ed1ab_0.tar.bz2 | conda | 0.1.2 | noarch | main | May 17, 2022, 05:19 PM | 125.29 KB | 2.6K | |
noarch/openff-bespokefit-0.1.1-pyhd8ed1ab_0.tar.bz2 | conda | 0.1.1 | noarch | main | Mar 18, 2022, 11:33 AM | 124.91 KB | 2.7K | |
noarch/openff-bespokefit-0.1.0-pyhd8ed1ab_0.tar.bz2 | conda | 0.1.0 | noarch | main | Feb 24, 2022, 06:04 PM | 119.01 KB | 2.5K |