Figure - PMC

Skip to main content

An official website of the United States government

Here's how you know

Here's how you know

Official websites use .gov
A .gov website belongs to an official government organization in the United States.

Secure .gov websites use HTTPS
A lock ( ) or https:// means you've safely connected to the .gov website. Share sensitive information only on official, secure websites.

View full-text article in PMC

. 2021 Nov 18;12:6679. doi: 10.1038/s41467-021-26995-1

Search in PMC
Search in PubMed
View in NLM Catalog
Add to search

© The Author(s) 2021

Open Access This article is licensed under a Creative Commons Attribution 4.0 International License, which permits use, sharing, adaptation, distribution and reproduction in any medium or format, as long as you give appropriate credit to the original author(s) and the source, provide a link to the Creative Commons license, and indicate if changes were made. The images or other third party material in this article are included in the article’s Creative Commons license, unless indicated otherwise in a credit line to the material. If material is not included in the article’s Creative Commons license and your intended use is not permitted by statutory regulation or exceeds the permitted use, you will need to obtain permission directly from the copyright holder. To view a copy of this license, visit http://creativecommons.org/licenses/by/4.0/.

PMC Copyright notice

Fig. 3 — a Chemical structures of PBDB-T, PBDB-T(OD), and the acceptor materials used. MD simulation results for b PBDB-T and c PBDB-T(OD) blended with IT4F. The side chains of PBDB-T stretch out, leaving the conjugated backbones highly accessible to IT4F, allowing for close parallel π stacking between the backbones and IT4F, while the side chains of PBDB-T(OD) fold back, covering the backbones, reducing the probability for IT4F to stack on the donor backbones. d RDF of the distances between the donor backbones and IT4F for the blends based on PBDB-T and PBDB-T(OD).