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**Problem Statement:** `Having a simple, no-nonsense queried database of antivirals that are BBB permeable or not? `
**Preliminary Approach:** @fwmeng88 's upcoming computational model to be applie…
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All,
I am wondering, at one point in my simulation, the run fails with a constantly decreasing dt (reaching a dt = 1e-25 or lower which is certainly a sign of instability in my solution - or in my …
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Tried installing with -yml file using conda, but vina abrupts the installation of environment on windows. Probably no python bindings for the same.
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Thanks for your help with earlier issues. Thought I would mention that some complementary work is now published (disclaimer: our work):
> Baird, S. G.; Homer, E. R.; Fullwood, D. T.; Johnson, O. K. F…
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Some IDEs store settings in folders that are not automatically `.gitignore`'d here. The three IDEs I know of that computational chemistry-ish developers use are
* VS Code - `.vscode/`, handled in #…
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Hi everyone,
I am Khanh Nguyen, I am a master student in Pharmaceutical Sciences and my supervisor is Dr. Thomas Velenosi. Our lab's research focuses on the study of metabolic biomarkers and lipid…
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**Project Lead**:
Alfredo Quevedo - @alfredoq
**Mentor**:
Gemma Turon - @gemmaturon
Welcome to OLS-9! This issue will be used to track your project and progress during the program. Please use…
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So there are a few options for generating propellant datasets:
A) We could scrape CEAWeb; but for each Mixture Ratio+exit pressure combination we'd need 60 plus data points (chamber pressure). So a…
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- [ ] CA-A CANCER JOURNAL FOR CLINICIANS
- [ ] LANCET
- [ ] NEW ENGLAND JOURNAL OF MEDICINE
- [ ] JAMA-JOURNAL OF THE AMERICAN MEDICAL ASSOCIATION
- [ ] NATURE REVIEWS MOLECULAR CELL BIOLOGY
…
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(originally by @fgeorgatos)
most of the content on this has been shamelessly copied^H^H^H^H^H^H borrowed from:
https://openwiki.uninett.no/metacenter:reference:noturcpe