DR-NTU (Data)

Metrics

1,147,281 Downloads

Featured Dataverses

In order to use this feature you must have at least one published or linked dataverse.

Publish Dataverse

Are you sure you want to publish your dataverse? Once you do so it must remain published.

Publish Dataverse

This dataverse cannot be published because the dataverse it is in has not been published.

Delete Dataverse

Are you sure you want to delete your dataverse? You cannot undelete this dataverse.

fileTypeGroupFacet: Archive

211 to 220 of 5,077 Results

Bacteria_CB983-001M0117_good_1.fq.gz Jul 3, 2026 - A host receptor knockout strategy reveals microbiome-dependent protection against diet-induced obesity by capsaicin Gzip Archive - 5.5 MB - MD5: 9a6c4945f5007d266615f4c49655ad8b
Bacteria_CB983-001M0117_good_2.fq.gz Jul 3, 2026 - A host receptor knockout strategy reveals microbiome-dependent protection against diet-induced obesity by capsaicin Gzip Archive - 5.8 MB - MD5: ed94fb2bb914f1c92ac6a2951c9e6a69
Case_Study_0_BN-1_Manuscript.zip Jun 29, 2026 - A Computational Workflow for Uncovering Photoinduced Electron Transfer Mechanisms in Fluorescent Molecules ZIP Archive - 3.4 GB - MD5: 5efe0e8485b56b5f33f2eb5db17830c8 Main manuscript dataset containing naphthalimide conformers, Gaussian calculations, conformational searches, scheduler files, and analysis workbooks.
Case_Study_A_BN1-SI.zip Jun 29, 2026 - A Computational Workflow for Uncovering Photoinduced Electron Transfer Mechanisms in Fluorescent Molecules ZIP Archive - 48.7 MB - MD5: 2c273b3b289794db250d92e08b417d5e Case Study A dataset containing locally excited (LE) and charge/electron-transfer (CT/ET) calculations performed using M06-2X. Comparison with the ωB97X-D results reported in the main text enables assessment of functional dependence. Despite small numerical differences, the relat...
Case_Study_B_BODIPY_Benchmarking.zip Jun 29, 2026 - A Computational Workflow for Uncovering Photoinduced Electron Transfer Mechanisms in Fluorescent Molecules ZIP Archive - 734.4 MB - MD5: 3af8811e82af72ec743e3c5e02c56dda BODIPY–aniline benchmarking calculations comparing density functionals, basis sets, and mixed-functional workflows.
Case_Study_C_Rhodamine.zip Jun 29, 2026 - A Computational Workflow for Uncovering Photoinduced Electron Transfer Mechanisms in Fluorescent Molecules ZIP Archive - 50.4 MB - MD5: 5f99e912d77611b6b3e23b18c120b776 Si-rhodamine calculations covering locally excited and charge-transfer states, with outputs and formatted checkpoint files.
Explicit_Solvation.zip Jun 29, 2026 - A Computational Workflow for Uncovering Photoinduced Electron Transfer Mechanisms in Fluorescent Molecules ZIP Archive - 62.5 MB - MD5: 8317f42dbf78189c5922543538ab98d2 BODIPY calculations examining the effects of zero, one, or two explicit water molecules alongside implicit ethanol solvation.
Scripts_and_GaussianStepMaker.zip Jun 29, 2026 - A Computational Workflow for Uncovering Photoinduced Electron Transfer Mechanisms in Fluorescent Molecules ZIP Archive - 38.5 MB - MD5: 288b763726c10df2ee96964e8b96d457 Python analysis utilities and the Gaussian calculation-step generator software package.
Video_Recordings_AllVideos.zip Jun 29, 2026 - A Computational Workflow for Uncovering Photoinduced Electron Transfer Mechanisms in Fluorescent Molecules ZIP Archive - 847.4 MB - MD5: 8fd460a25ce2f1609e70b9e23582d8eb This ZIP archive contains all video tutorials accompanying the protocol and enables users to download the complete collection at once. Each tutorial is also available separately for users who wish to download individual videos.
NTU-PVK-photoanode-2026 - Open Data.rar Jun 27, 2026 - Replication Data for: Automated photoelectrochemical testing platform for screen-printed, noble-metal free perovskite photoanodes Compressed Archive - 82.2 MB - MD5: b51e5dff8ee988b7d85baefafc456468 Compact Open Data archive

Bacteria_CB983-001M0117_good_1.fq.gz

Jul 3, 2026 - A host receptor knockout strategy reveals microbiome-dependent protection against diet-induced obesity by capsaicin

Gzip Archive - 5.5 MB -

Bacteria_CB983-001M0117_good_2.fq.gz

Jul 3, 2026 - A host receptor knockout strategy reveals microbiome-dependent protection against diet-induced obesity by capsaicin

Gzip Archive - 5.8 MB -

Case_Study_0_BN-1_Manuscript.zip

Jun 29, 2026 - A Computational Workflow for Uncovering Photoinduced Electron Transfer Mechanisms in Fluorescent Molecules

ZIP Archive - 3.4 GB -

Main manuscript dataset containing naphthalimide conformers, Gaussian calculations, conformational searches, scheduler files, and analysis workbooks.

Case_Study_A_BN1-SI.zip

Jun 29, 2026 - A Computational Workflow for Uncovering Photoinduced Electron Transfer Mechanisms in Fluorescent Molecules

ZIP Archive - 48.7 MB -

Case Study A dataset containing locally excited (LE) and charge/electron-transfer (CT/ET) calculations performed using M06-2X. Comparison with the ωB97X-D results reported in the main text enables assessment of functional dependence. Despite small numerical differences, the relat...

Case_Study_B_BODIPY_Benchmarking.zip

Jun 29, 2026 - A Computational Workflow for Uncovering Photoinduced Electron Transfer Mechanisms in Fluorescent Molecules

ZIP Archive - 734.4 MB -

BODIPY–aniline benchmarking calculations comparing density functionals, basis sets, and mixed-functional workflows.

Case_Study_C_Rhodamine.zip

Jun 29, 2026 - A Computational Workflow for Uncovering Photoinduced Electron Transfer Mechanisms in Fluorescent Molecules

ZIP Archive - 50.4 MB -

Si-rhodamine calculations covering locally excited and charge-transfer states, with outputs and formatted checkpoint files.

Explicit_Solvation.zip

Jun 29, 2026 - A Computational Workflow for Uncovering Photoinduced Electron Transfer Mechanisms in Fluorescent Molecules

ZIP Archive - 62.5 MB -

BODIPY calculations examining the effects of zero, one, or two explicit water molecules alongside implicit ethanol solvation.

Scripts_and_GaussianStepMaker.zip

Jun 29, 2026 - A Computational Workflow for Uncovering Photoinduced Electron Transfer Mechanisms in Fluorescent Molecules

ZIP Archive - 38.5 MB -

Python analysis utilities and the Gaussian calculation-step generator software package.

Video_Recordings_AllVideos.zip

Jun 29, 2026 - A Computational Workflow for Uncovering Photoinduced Electron Transfer Mechanisms in Fluorescent Molecules

ZIP Archive - 847.4 MB -

This ZIP archive contains all video tutorials accompanying the protocol and enables users to download the complete collection at once. Each tutorial is also available separately for users who wish to download individual videos.

NTU-PVK-photoanode-2026 - Open Data.rar

Jun 27, 2026 - Replication Data for: Automated photoelectrochemical testing platform for screen-printed, noble-metal free perovskite photoanodes

Compressed Archive - 82.2 MB -

Compact Open Data archive

Add Data

Share Dataverse

Link Dataverse

Reset Modifications