Multitask machine learning collective variable for 5D models and alanine dipeptide

Name: Multitask machine learning collective variable for 5D models and alanine dipeptide
Creator: Harvard University
Published: 2021-01-01T00:00:00+08:00

Harvard Dataverse2021-12-30 更新2026-04-09 收录

分子动力学采样

机器学习集体变量

数据链接：

https://dataverse.harvard.edu/citation?persistentId=doi:10.7910/DVN/XLD7VD 数据链接链接失效反馈

官方服务：

资源简介：

Simulation scripts, training scripts, and training/test sets for 5D Mueller-Brown and three-hole model published in the paper.

提供机构：

Harvard University

创建时间：

2021-01-01

Multitask machine learning collective variable for 5D models and alanine dipeptide

资源简介：

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