pjmartel

pjmartel's Stars

• minimaxir/simpleaichat

  Python package for easily interfacing with chat apps, with robust features and minimal code complexity.

  Language:Python3.5k3582230

• NebuTech/NBMiner

  GPU Miner for ETH, RVN, BEAM, CFX, ZIL, AE, ERGO

  3.2k179877518

• lucidrains/alphafold2

  To eventually become an unofficial Pytorch implementation / replication of Alphafold2, as details of the architecture get released

  Language:Python1.6k6449258

• mdtraj/mdtraj

  An open library for the analysis of molecular dynamics trajectories

  Language:Python593471k280

• ParmEd/ParmEd

  Parameter/topology editor and molecular simulator

  Language:Python39532664149

• gordicaleksa/pytorch-neural-style-transfer

  Reconstruction of the original paper on neural style transfer (Gatys et al.). I've additionally included reconstruction scripts which allow you to reconstruct only the content or the style of the image - for better understanding of how NST works.

  Language:Python37381279

• Valdes-Tresanco-MS/gmx_MMPBSA

  gmx_MMPBSA is a new tool based on AMBER's MMPBSA.py aiming to perform end-state free energy calculations with GROMACS files.

  Language:Python224946965

• Amber-MD/pytraj

  Python interface of cpptraj

  Language:Jupyter Notebook1701727838

• ramiromagno/gwasrapidd

  gwasrapidd: an R package to query, download and wrangle GWAS Catalog data

  Language:R9144614

• sbl-sdsc/mmtf-pyspark

  Methods for the parallel and distributed analysis and mining of the Protein Data Bank using MMTF and Apache Spark.

  Language:Python67810227

• mms-fcul/PypKa

  A python module for flexible Poisson-Boltzmann based pKa calculations with proton tautomerism

  Language:Python5461710

• sib-swiss/react-dotlet

  Full JS version of Dotlet

  Language:JavaScript18643

• gmagno/tmon

  Temperature Monitor -- a simple CLI tool for monitoring/reporting CPU temperatures.

  Language:Python10250