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alusimulator

A Java project finished in 2015, course project of Computer Organization and System Architecture

avlmini

AVL implementation which is as fast/compact as linux's rbtree

awesome-actions

A curated list of awesome actions to use on GitHub

awesome-cheatsheets

超级速查表 - 编程语言、框架和开发工具的速查表，单个文件包含一切你需要知道的东西 :zap:

beamer_template

A toolchain to make beautiful Beamer presentations without fussing with LaTeX.

building-trading-bots

Building Trading Algorithms with Python, published by Packt

chemdistiller

a modified tandem MS spectrum annotation software

chemoinformatics

curriculum-vitae

deep_scaffold

deepchem

Democratizing Deep-Learning for Drug Discovery, Quantum Chemistry, Materials Science and Biology

deepmind-research

This repository contains implementations and illustrative code to accompany DeepMind publications

drug_activity_detection

Detecting activity of drugs based on topological features and molecules characteristics. Problem: High dimensional sparse features, small training data and highly imbalanced classes. Handled it using PCA, SMOTE Sampling and Ensemble Technique using Gradient Boosting Algorithm. Obtained 1st rank .

github-slideshow

A robot powered training repository :robot:

how-to-write-makefile

跟我一起写Makefile重制版

jane-street-solutions

Solutions to the Jane St monthly puzzles

java-2017f

local_stock_mongodb

Download and store stock data locally

mdanalysis

MDAnalysis is a Python library to analyze molecular dynamics simulations.

merck

Merck Molecular Activity Challenge

mongodb-in-docker

mrqeoqqt.github.io

msmbuilder

:building_construction: Statistical models for biomolecular dynamics :building_construction:

msmbuilder2022

Statistical models for biomolecular dynamics

njuthesis

南京大学本科毕业论文模板

nucleicnet

physical-chemistry-experiment-reports

prolif

Protein-Ligand Interaction Fingerprints

protac-model

Integrative modeling of PROTAC-mediated ternary complex

pymol-script-repo

Collected scripts for Pymol