86 results
- Go to itemThis node ensures the existence of a specific configurable Conda environment and propagates the environment to Python, R, or othe…2
- Go to itemAllows executing a Python script in a local Python environment. The environment has to be configured under File → Preferences → K…2
- Go to itemThis workflow shows an example of the usage of the following nodes: * Conda Environment Propagation node: a pre-configured conda …1
- Go to itemThis node allows you to execute arbitrary java code to create new columns or replace existing ones. Enter the java code in the te…1
- Go to itemAllows executing a Python script in a local Python environment. The environment has to be configured under File → Preferences → K…1
- Go to itemThe node allows executing a Python script in a local Python 3 environment. The environment has to be configured under File → Pref…1
- Go to itemAllows executing a Python script in a local Python environment. The environment has to be configured under File → Preferences → K…1
- Go to itemThis is an example workflow to run with knimepy Python package. A Container Output (Table) at the end of the workflow provides th…0
- Go to itemThe Chemistry external tool nodes can be used to parse a log file with basic shell commands, run Shrodinger utilities or backends…0
- Go to itemThe Python Script nodes are used to extract ring properties, run a Macromodel conformational search with specific parameters, and…0
- Go to itemThe Python Script nodes are used to extract ring properties, run a Macromodel conformational search with specific parameters, and…0
- Go to itemUses the KNIME-Maestro connector (replacing the Run Maestro 1:1 metanode) to alter some structures in the middle of a workflow, p…0
- Go to itemThis is an example workflow to run with knimepy Python package. A Container Output (Table) at the end of the workflow provides th…0
- Go to itemThe Chemistry external tool nodes can be used to parse a log file with basic shell commands, run Shrodinger utilities or backends…0
- Go to itemProtein descriptors are calculated for supplied structure using calc_protein_descriptors.py Sequence descriptors are calculated f…0
- Go to itemThe Run maestro command node is used to alter the formal charge of some atoms defined by an ASL and for altering the structure re…0
- Go to itemThis workflow uses the new Python Script node. This node features a new backend that makes execution of Python scripts as fast in…0
- Go to itemThe data table from the input port is imported into the R workspace as variable knime.in ; existing variables are overwritten in …0
- Go to itemThis node allows users to run a user-specified external program that inputs up to 3 columns and outputs 3 columns. The allowed in…0