karlkirschner's Repositories

Python3 script for compiling latex documents using pdflatex.

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DFG-Basic-Module-Latex

A Latex class and tex file for writing grant proposal for DFG's Basic Module in English.

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Python3 script to covert a World Band dta-formatted data file to acsv-formatted file.

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Example_MD_Protein_Ligand

Two examples (implicit and explicit water) for model preparation and execution of MD simulations for a protein with a bound ligand.

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familytreemaker

Generates a family tree graph from a simple text file

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H-BRS_MethodsTraining

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hbrs_letterhead

A latex template for an H-BRS letter.

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hbrs_machine_learning_tutorials

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Short examples of Latex documents, plus a Python3 code for compiling them.

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latex_presentation_hbrs

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Peer-Review-Lecture

Graduate student lecture for conducting peer review.

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Piel_Atom_Typing

Nico Piel's bachelor thesis research for atom typing.

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PyPeerReview-Matching

Python script to facilitate the matching of reviewers with reviewees, using CSV-formatted input files

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Python_Grading_GUIs

Collection of grading schemes used in my courses.

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Original: A. Alenaizan's restricted electrostatic potential (RESP) plugin to Psi4

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SARS-CoV-2-3D-Structures

Three-dimensional conformations of potential active compounds for SARS-Cov-2 treatment determined using quantum mechanics theories.

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Scientific_Programming_Course

Course material for Scientific Programming with Python given at University of Applied Science Bonn-Rhein-Sieg.

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scipro_assignments_grading

This repository provides a brower-based feedback form concerning student homework solutions for a Python course. While specific for my own course, it can be easily adapted for other courses.

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scipro_grading_testing

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