Rodrigo Vargas Honorato

Results 23 issues of Rodrigo Vargas Honorato

You are about to submit a new Pull Request. Before continuing make sure you read the [contributing guidelines](CONTRIBUTING.md) and that you comply with the following criteria: - [x] You have...

execution
yaml default parameters

**Description** The modules use a `.yaml` file to define its parameters - however their format and schema are not validated on loading. So it's possible to add [repeated parameters](https://github.com/haddocking/haddock3/pull/896/files#diff-d35a74716cfb7b4fc3992ea058705e448e0be53e97ca1ad40a589fd347d54af2) or...

enhancement
yaml default parameters

This PR adds instructions on how to develop haddock3 and also updates the `setup.py` to include a `CustomDevelop` instruction class

documentation

You are about to submit a new Pull Request. Before continuing make sure you read the [contributing guidelines](CONTRIBUTING.md). ## Checklist - [ ] Tests added for the new code -...

You are about to submit a new Pull Request. Before continuing make sure you read the [contributing guidelines](CONTRIBUTING.md). ## Checklist - [ ] Tests added for the new code -...

## **Desired feature/enhancement** Update minimal python version to a recent release ## **Motivation** Currently the recomended python version is 3.9, which is already a quite old version and [it's marked...

enhancement
CI / repository
dependencies
workflow

## **Desired feature/enhancement** Refactor code that is splitting tasks in the modules ## **Motivation** `libparallel` recieves a set of tasks and handles the split and balancing of them, however this...

enhancement
execution

## **Desired feature/enhancement** Remove all the restraints-related CLIs from the codebase ## **Motivation** The current implementations of restraint generation routines are a port of an old and limited routines extracted...

enhancement