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12306

12306智能刷票，订票

automatic-equilibration-detection

Automatic detection of equilibrated regions of molecular simulations

bayesianoptimization

A Python implementation of global optimization with gaussian processes.

confinedsys-cylinder

my research codes

cycle-chains

check morphology for Qiuwenjuan of cycle-chains

easy_ai_simu

galamost-5

gpt4free

decentralising the Ai Industry, free gpt-4/3.5 scripts through several reverse engineered api's ( poe.com, phind.com, chat.openai.com, phind.com, writesonic.com, sqlchat.ai, t3nsor.com, you.com etc...)

hardshpere_cylinder_slp

Finding the dense packing structure of hard spheres in cylindrical pores by sequential linear programming (SLP) mthod.

lammps

Public development project of the LAMMPS MD software package

lammpstutorials.github.io

LAMMPS tutorials for both beginners and advanced users

machinelearning

My blogs and code for machine learning. http://cnblogs.com/pinard

mayavi

3D visualization of scientific data in Python

metadynamics-plugin

Metadynamics plugin for HOOMD-blue

nkthesis

南开大学硕士毕业论文/博士论文模板 (Latex Template for Nankai University)

nku2020-hds-innovativeprojects

2020年NKU”百项工程“小组

packing-generation

Hard-sphere packing generation in C++ with the Lubachevsky–Stillinger, Jodrey–Tory, and force-biased algorithms and packing post-processing.

paramonte

ParaMonte: Plain Powerful Parallel Monte Carlo and MCMC Library for Python, MATLAB, Fortran, C++, C.

pdc

Efficient phase diagram construction based on uncertainty sampling

polysmart

Perform polymerization and crosslinking in MARTINI coarse-grained forcefield using GROMACS MD package

pscfpp

Polymer Self-Consistent Field Theory (C++/CUDA version)

pylat

pymbar

Python implementation of the multistate Bennett acceptance ratio (MBAR)

pymol-open-source

Open-source foundation of the user-sponsored PyMOL molecular visualization system.

pypolybuilder

pysimm

python simulation interface for molecular modeling

python-ternary

:small_red_triangle: Ternary plotting library for python with matplotlib

radonpy

RadonPy is a Python library to automate physical property calculations for polymer informatics.

research_of_grafting_solution

the project is about codes in my Master's research of grafting Homopolymers brushes and AB block copolymers solutions blends

rmd_digging

RMD_digging is aimed to provide pre-processing and post-processing tools for the reactive molecular dynamics (ReaxFF) simulations based on MATLAB language, including formatting the reactive force field parameters, statistic anasysis of structures, trajectories and mechanisms and output of the visualization files.