PKUfjh/Uni-Fold Fork of dptech-corp/Uni-Fold

An open-source platform for developing protein models beyond AlphaFold.

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PKUfjh/alphaflow Fork of bjing2016/alphaflow

AlphaFold Meets Flow Matching for Generating Protein Ensembles

Language: Python - Size: 3.08 MB - Last synced: 2 months ago - Pushed: 2 months ago - Stars: 0 - Forks: 0

PKUfjh/Uni-Core Fork of dptech-corp/Uni-Core

an efficient distributed PyTorch framework

Language: Python - Size: 268 KB - Last synced: 7 months ago - Pushed: 7 months ago - Stars: 0 - Forks: 0

PKUfjh/lammpscn2 Fork of Roy-Kid/lammpscn2

[WIP] Refactoring lammpscn website

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PKUfjh/rid-kit Fork of deepmodeling/rid-kit

Reinforced dynamics

Language: Python - Size: 9.61 MB - Last synced: 8 months ago - Pushed: 8 months ago - Stars: 4 - Forks: 0

PKUfjh/protein_flow

This is the repo to generate data for training generative models for protein

Language: Python - Size: 1.22 MB - Last synced: 11 months ago - Pushed: 11 months ago - Stars: 0 - Forks: 0

PKUfjh/RiD-images

Images in RiD

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PKUfjh/Gencorr

Generalized Correlation based on mutual information

Language: Python - Size: 1.54 MB - Last synced: 3 months ago - Pushed: 3 months ago - Stars: 0 - Forks: 0

PKUfjh/dpdispatcher Fork of deepmodeling/dpdispatcher

generate HPC scheduler systems jobs input scripts and submit these scripts to HPC systems and poke until they finish

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PKUfjh/dpdata Fork of deepmodeling/dpdata

Manipulating multiple atomic simulation data formats, including DeePMD-kit, VASP, LAMMPS, ABACUS, etc.

Language: Python - Size: 4.82 MB - Last synced: about 1 year ago - Pushed: over 1 year ago - Stars: 0 - Forks: 0

PKUfjh/deepmd-kit Fork of deepmodeling/deepmd-kit

A deep learning package for many-body potential energy representation and molecular dynamics

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PKUfjh/sphinx-tutorial

This is the repo for me to learn sphinx

Language: Python - Size: 20.5 KB - Last synced: about 1 year ago - Pushed: almost 2 years ago - Stars: 0 - Forks: 0

PKUfjh/docker-files Fork of Ericwang6/docker-files

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PKUfjh/GPUMD Fork of brucefan1983/GPUMD

Graphics Processing Units Molecular Dynamics

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PKUfjh/DecryptLogin Fork of CharlesPikachu/DecryptLogin

DecryptLogin: APIs for loginning some websites by using requests.

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PKUfjh/JDCaptchaCrack Fork of gebiWangshushu/JDCaptchaCrack

Python + Selenium+chromedirver 破解京东登录滑块验证码

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PKUfjh/poscar2xsf Fork of houzf/poscar2xsf

Convert a POSCAR-format-like file to a XSF file (visualized by XCrySDen)

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PKUfjh/deepchem Fork of deepchem/deepchem

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

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PKUfjh/EpeAutoReserve Fork of zyHan2077/EpeAutoReserve

北京大学/北大/PKU 智慧场馆 场地预约 自动化

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PKUfjh/dpgen Fork of deepmodeling/dpgen

The deep potential generator

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PKUfjh/ML-in-condensed-matter-physics

Language: Python - Size: 21.5 MB - Last synced: about 1 year ago - Pushed: almost 2 years ago - Stars: 0 - Forks: 1

PKUfjh/molecular_simulation

Language: C++ - Size: 111 MB - Last synced: about 1 year ago - Pushed: over 2 years ago - Stars: 1 - Forks: 0

PKUfjh/deepks-kit Fork of deepmodeling/deepks-kit

a package for developing machine learning-based chemically accurate energy and density functional models

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PKUfjh/qndxx-beijing Fork of ouyen/qndxx-beijing

Size: 69.3 KB - Last synced: about 1 year ago - Pushed: over 2 years ago - Stars: 0 - Forks: 0

PKUfjh/ferminet Fork of deepmind/ferminet

An implementation of the Fermionic Neural Network for ab-initio electronic structure calculations

Language: Python - Size: 86.2 MB - Last synced: about 1 year ago - Pushed: over 2 years ago - Stars: 0 - Forks: 0

PKUfjh/deepqmc Fork of deepqmc/deepqmc

Deep learning quantum Monte Carlo for electrons in real space

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PKUfjh/PKUAutoSubmit Fork of Bruuuuuuce/PKUAutoSubmit

PKU一键出入校备案小工具

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PKUfjh/abacus-develop Fork of deepmodeling/abacus-develop

An electronic structure package based on either plane wave basis or numerical atomic orbitals.

Language: C++ - Size: 58.7 MB - Last synced: about 1 year ago - Pushed: over 2 years ago - Stars: 0 - Forks: 0

PKUfjh/ipv6-hosts Fork of lennylxx/ipv6-hosts

Language: Python - Size: 6.98 MB - Last synced: about 1 year ago - Pushed: over 5 years ago - Stars: 0 - Forks: 0