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| Preview | Issue Date | Title | Author(s) | Program | Calculation type | Method(s) | Basis Set | Energy | Solv. | Vibr. | Orb. |
|---|---|---|---|---|---|---|---|---|---|---|---|
 | 26-Jan-2023 | streptomycin_CONF469_water | Pulgar Rubio, Antonio | Orca; 5.0.2; RELEASE | Single point | - | def2-TZVPP | -2110.01459475; Eh | |||
 | 26-Jan-2023 | streptomycin_CONF359_water | Pulgar Rubio, Antonio | Orca; 5.0.2; RELEASE | Single point | - | def2-TZVPP | -2110.01925395; Eh | |||
 | 26-Jan-2023 | streptomycin_CONF272_water | Pulgar Rubio, Antonio | Orca; 5.0.2; RELEASE | Single point | - | def2-TZVPP | -2110.01926077; Eh | |||
 | 26-Jan-2023 | kasugamycin_CONF431_gas | Pulgar Rubio, Antonio | Orca; 5.0.2; RELEASE | Single point | - | def2-TZVPP | -1390.01211604; Eh | |||
 | 26-Jan-2023 | kasugamycin_CONF43_gas | Pulgar Rubio, Antonio | Orca; 5.0.2; RELEASE | Single point | - | def2-TZVPP | -1390.01355620; Eh | |||
 | 26-Jan-2023 | kasugamycin_CONF299_gas | Pulgar Rubio, Antonio | Orca; 5.0.2; RELEASE | Single point | - | def2-TZVPP | -1390.01323483; Eh | |||
 | 26-Jan-2023 | kasugamycin_CONF58_water | Pulgar Rubio, Antonio | Orca; 5.0.2; RELEASE | Single point | - | def2-TZVPP | -1390.06892657; Eh | |||
 | 26-Jan-2023 | kasugamycin_CONF51_water | Pulgar Rubio, Antonio | Orca; 5.0.2; RELEASE | Single point | - | def2-TZVPP | -1390.06830647; Eh | |||
 | 26-Jan-2023 | kasugamycin_CONF50_water | Pulgar Rubio, Antonio | Orca; 5.0.2; RELEASE | Single point | - | def2-TZVPP | -1390.06769479; Eh | |||
 | 26-Jan-2023 | kasugamycin_CONF596_water | Pulgar Rubio, Antonio | Orca; 5.0.2; RELEASE | Single point | - | def2-TZVPP | -1390.06819372; Eh |
Results 141-150 of 155 (Search time: 0.001 seconds).