MolSSI-Education/python-package-best-practices MolSSI-Education/python-package-best-practices

  • Stars
    star
    37
  • Rank 720,807 (Top 15 %)
  • Language
    Python
  • License
    Other
  • Created about 5 years ago
  • Updated 7 months ago
Twitter logo Share LinkedIn logo Share Facebook logo Share
MolSSI-Education/python-package-best-practices
github

MolSSI-Education

Reviews

There are no reviews yet. Be the first to send feedback to the community and the maintainers!

Repository Details

Hands-on workshop showing good software development practices to create a Python package.

More Repositories

1

python_scripting_cms

Python Data and Scripting course for computational chemists
Python
82
star
2

getting-started-computational-chemistry

Python
17
star
3

CMS-Python-DevOps

This is the older version of our Python Package Development Workshop - Please see our updated materials -
Python
16
star
4

parallel-programming

Python
14
star
5

S2I2

Code and other materials for the S2I2 Software Summer School
C++
12
star
6

periodic-table

JavaScript
11
star
7

gpu_programming_beginner

Fundamentals of heterogeneous parallel programming with CUDA C/C++ at the beginner level.
Python
9
star
8

acs-2023-notebooks

Jupyter Notebook
9
star
9

Mercury-2018

This is the information for the Mercury workshop July 2018
Jupyter Notebook
7
star
10

oop_and_design_patterns

Python
7
star
11

python-scripting-biochemistry

Jupyter Notebook
6
star
12

pybind-tutorial

Examples for binding C++ and Python
C++
5
star
13

qm-tools

MolSSI Quantum Mechanics Tools workshop
Jupyter Notebook
5
star
14

iqb-crash-course-2023

Jupyter Notebook
5
star
15

molssi-cheminformatics

Jupyter Notebook
5
star
16

python-visualization

Under development - python visualization tutorial/workshop
Jupyter Notebook
4
star
17

type-hints-pydantic-tutorial

A hands-on tutorial on Python type hints, dataclasses, and pydantic.
Jupyter Notebook
4
star
18

2020-software-fellow-posters

JavaScript
3
star
19

lesson-template

Python
3
star
20

python-data-science-chemistry

Jupyter Notebook
3
star
21

mm-tools

Python
3
star
22

python-data-analysis

Short lessons for data analysis using Python
Python
3
star
23

molssi-education.github.io

http://molssi-education.github.io
SCSS
2
star
24

Notes_SSS_2017

Notes from the 2017 MolSSI Software Summer School
2
star
25

ab-initio-md

Jupyter Notebook
1
star
26

QM_2017_SSS_Team1

Python
1
star
27

mm_2019_sss_3

Python
1
star
28

MM_SSS_Lesson_Plan

The Molecular Mechanics Software Summer School Lesson Plan
TeX
1
star
29

intro-python-data-science

Jupyter Notebook
1
star
30

cpp_programming

Lessons introducing the C++ programming language
Python
1
star
31

QM_2017_SSS_Team2

Python
1
star
32

qm_2019_sss_4

Python
1
star
33

sss_2019_lessons

Python
1
star
34

QM_2017_SSS_Team5

Upstream repo for QM5
Python
1
star
35

QM_2017_SSS_Team9

Python
1
star