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Mod version 1.12.2 - 2.2.19.0, within modpack "Antimatter Chemistry" version 1.2.34.
Randomly when using the jetpack it stops making flying sounds.
Only relaunching the modpack will re-enable the so…
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It seems here:
https://github.com/OpenMS/OpenMS/blob/637747ce64bd159309dac7f9f6b3ac728a60dd31/src/openms/source/CHEMISTRY/AASequence.cpp#L378
the order of AASequence is determined by the order …
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I'm wondering if there is an option to make AMDock automatically dock multiple ligands after each other with Autodock4Zn. I'm going to dock 200 ligands and I don't want to start a new project and chec…
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With a growing CRANE user base, especially of experimentalists who want to model their plasma experiment's chemistry, it's becoming clear that CRANE's documentation needs to be expanded to help onboar…
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Hello, thanks for the lovely and clean package!
I'm curious if you've considered adding a ``calc_hessian`` call to ``Engine()``, so that analytic Hessians might be employed where possible? I know `…
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### Describe your feature request precisely
A researcher working with chemicals noticed it would be nice to be able to add images to resource categories. This would mean be they could add all possi…
nap84 updated
2 months ago
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In Colloid and Surface Chemistry lab
Go to - Experiments - Demonstration of the Surface-Effect on Chemical Properties of Finely Divided Particles - References
If we cl…
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In Colloid and Surface Chemistry lab
Go to - Experiments - Demonstration of the Surface-Effect on Chemical Properties of Finely Divided Particles - References
If we cl…
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Hello, I trained my own CSV dataset by using chainer-chemistry, but I only got MAE when I used the model for prediction. How can I get the prediction value of each test data? I want to be able to comp…
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nglview and nglviewer natively support multiple crd and trajectory formats. The viewer in Galaxy only supports PDB. Mol2, SDF and Gro are supported datatypes for cheminformatics and computational chem…