list | MatDaCs

2DMAT

2DMAT is a framework designed to apply search algorithms to forward problem solvers to find optimal solutions.…続きを読む

AAindex is a database that gathers biophysical and chemical properties related to the amino acid sequences of …続きを読む

AFLOWpi is a Python framework for high throughput ab initio calculations. It is designed to manage ab initio c…続きを読む

AiiDA is an open-source Python library that helps manage computational tasks and data. It can record the histo…続きを読む

Atomate is an open-source library for automated materials calculations. Atomate provides standard workflows fo…続きを読む

AtomWork-Adv is a database of inorganic materials that contains approximately 1,000 journal entries on crysta…続きを読む

The Cambridge Structure Database (CSD) is a database of small molecule organic and organometallic crystal stru…続きを読む

ChatGPT is a large language model developed by OpenAI, excelling in natural language processing. It can answer…続きを読む

ChEMBL is a comprehensive database of biologically active compounds, serving as a crucial resource in drug dis…続きを読む

COMPARED (COMPutation ARchive of Exact Diagonalization) is a database that stores exhaustive calculation resul…続きを読む