Veganism Social

0 posts0 participants0 posts today

Robert Pollice<a href="https://mstdn.science/tags/RobSelects" class="mention hashtag" rel="nofollow noopener noreferrer" target="_blank">#RobSelects</a> preprint of the week <a href="https://mstdn.science/tags/ChemRxiv" class="mention hashtag" rel="nofollow noopener noreferrer" target="_blank">#ChemRxiv</a>: Restricting computational chemistry benchmark sets in size while keeping their error distributions. <a href="https://mstdn.science/tags/compchem" class="mention hashtag" rel="nofollow noopener noreferrer" target="_blank">#compchem</a> <a href="https://doi.org/10.26434/chemrxiv-2025-949xn" rel="nofollow noopener noreferrer" translate="no" target="_blank">https://doi.org/10.26434/chemrxiv-2025-949xn</a>

Andrés Manuel ÁlvarezA pleasant and instructive reading before going to sleep 🤓<a href="https://mastodon.social/tags/chemistry" class="mention hashtag" rel="nofollow noopener noreferrer" target="_blank">#chemistry</a> <a href="https://mastodon.social/tags/book" class="mention hashtag" rel="nofollow noopener noreferrer" target="_blank">#book</a> <a href="https://mastodon.social/tags/science" class="mention hashtag" rel="nofollow noopener noreferrer" target="_blank">#science</a> <a href="https://mastodon.social/tags/catalysis" class="mention hashtag" rel="nofollow noopener noreferrer" target="_blank">#catalysis</a> <a href="https://mastodon.social/tags/compchem" class="mention hashtag" rel="nofollow noopener noreferrer" target="_blank">#compchem</a>

FACCTsCheck out the recent work by ‪Olexandr Isayev (<a href="https://mastodon.social/@olexandr" class="u-url mention" rel="nofollow noopener noreferrer" target="_blank">@olexandr</a>) and co-workers utilizing ORCA to create DFT reference data in the framework of their Transferable Machine Learning Interatomic Potential for Pd-Catalyzed Cross-Coupling Reactions.<a href="https://chemrxiv.org/engage/chemrxiv/article-details/67d7b7f7fa469535b97c021a" rel="nofollow noopener noreferrer" translate="no" target="_blank">https://chemrxiv.org/engage/chemrxiv/article-details/67d7b7f7fa469535b97c021a</a><a href="https://mastodon.social/tags/ORCAqc" class="mention hashtag" rel="nofollow noopener noreferrer" target="_blank">#ORCAqc</a> <a href="https://mastodon.social/tags/CompChem" class="mention hashtag" rel="nofollow noopener noreferrer" target="_blank">#CompChem</a> <a href="https://mastodon.social/tags/QuantumChem" class="mention hashtag" rel="nofollow noopener noreferrer" target="_blank">#QuantumChem</a> <a href="https://mastodon.social/tags/ML" class="mention hashtag" rel="nofollow noopener noreferrer" target="_blank">#ML</a> <a href="https://mastodon.social/tags/MachineLearning" class="mention hashtag" rel="nofollow noopener noreferrer" target="_blank">#MachineLearning</a>

Robert Pollice<a href="https://mstdn.science/tags/RobSelects" class="mention hashtag" rel="nofollow noopener noreferrer" target="_blank">#RobSelects</a> paper of the week <a href="https://mstdn.science/tags/angew_chem" class="mention hashtag" rel="nofollow noopener noreferrer" target="_blank">#angew_chem</a>: A global optimization and structure sampling algorithm that does not rely on molecular dynamics. <a href="https://mstdn.science/tags/compchem" class="mention hashtag" rel="nofollow noopener noreferrer" target="_blank">#compchem</a> <a href="https://doi.org/10.1002/anie.202500393" rel="nofollow noopener noreferrer" translate="no" target="_blank">https://doi.org/10.1002/anie.202500393</a>

FACCTsCheck out the recent work by Pantazis and Santra (MPI Kofo) who use ORCA's rich quantum chemistry toolkit to investigate the conformational profile of Galactose-α-1,3-Galactose (α-Gal) and the structural basis of its immunological response.<a href="https://doi.org/10.1002/chem.202500050" rel="nofollow noopener noreferrer" translate="no" target="_blank">https://doi.org/10.1002/chem.202500050</a><a href="https://mastodon.social/tags/ORCAqc" class="mention hashtag" rel="nofollow noopener noreferrer" target="_blank">#ORCAqc</a> <a href="https://mastodon.social/tags/CompChem" class="mention hashtag" rel="nofollow noopener noreferrer" target="_blank">#CompChem</a> <a href="https://mastodon.social/tags/QuantumChem" class="mention hashtag" rel="nofollow noopener noreferrer" target="_blank">#QuantumChem</a> <a href="https://mastodon.social/tags/CompChemSky" class="mention hashtag" rel="nofollow noopener noreferrer" target="_blank">#CompChemSky</a> <a href="https://mastodon.social/tags/ChemSky" class="mention hashtag" rel="nofollow noopener noreferrer" target="_blank">#ChemSky</a>

Bose-Einstein-Kondensat6/n If you want to support our work, you could become part of our <a href="https://mstdn.social/tags/community" class="mention hashtag" rel="nofollow noopener noreferrer" target="_blank">#community</a> efforts by a Rechenkraft.net <a href="https://mstdn.social/tags/charity" class="mention hashtag" rel="nofollow noopener noreferrer" target="_blank">#charity</a> <a href="https://mstdn.social/tags/membership" class="mention hashtag" rel="nofollow noopener noreferrer" target="_blank">#membership</a> and add your ideas to ours. ;-) <a href="https://mstdn.social/tags/DIYbio" class="mention hashtag" rel="nofollow noopener noreferrer" target="_blank">#DIYbio</a> <a href="https://mstdn.social/tags/lab" class="mention hashtag" rel="nofollow noopener noreferrer" target="_blank">#lab</a> <a href="https://mstdn.social/tags/instruments" class="mention hashtag" rel="nofollow noopener noreferrer" target="_blank">#instruments</a> <a href="https://mstdn.social/tags/OpenSource" class="mention hashtag" rel="nofollow noopener noreferrer" target="_blank">#OpenSource</a> <a href="https://mstdn.social/tags/chemistry" class="mention hashtag" rel="nofollow noopener noreferrer" target="_blank">#chemistry</a> <a href="https://mstdn.social/tags/bioinformatics" class="mention hashtag" rel="nofollow noopener noreferrer" target="_blank">#bioinformatics</a> <a href="https://mstdn.social/tags/CompChem" class="mention hashtag" rel="nofollow noopener noreferrer" target="_blank">#CompChem</a> <a href="https://mstdn.social/tags/AugmentedReality" class="mention hashtag" rel="nofollow noopener noreferrer" target="_blank">#AugmentedReality</a> <a href="https://mstdn.social/tags/MINT" class="mention hashtag" rel="nofollow noopener noreferrer" target="_blank">#MINT</a> <a href="https://mstdn.social/tags/Schule" class="mention hashtag" rel="nofollow noopener noreferrer" target="_blank">#Schule</a> <a href="https://mstdn.social/tags/Lehre" class="mention hashtag" rel="nofollow noopener noreferrer" target="_blank">#Lehre</a> <a href="https://mstdn.social/tags/STEM" class="mention hashtag" rel="nofollow noopener noreferrer" target="_blank">#STEM</a> <a href="https://mstdn.social/tags/education" class="mention hashtag" rel="nofollow noopener noreferrer" target="_blank">#education</a> <a href="https://mstdn.social/tags/TiltFive" class="mention hashtag" rel="nofollow noopener noreferrer" target="_blank">#TiltFive</a>

Bose-Einstein-Kondensat5/n We are also in close contact with <a href="https://mstdn.social/tags/Richtsbergschule" class="mention hashtag" rel="nofollow noopener noreferrer" target="_blank">#Richtsbergschule</a> in <a href="https://mstdn.social/tags/Marburg" class="mention hashtag" rel="nofollow noopener noreferrer" target="_blank">#Marburg</a> where <a href="https://mstdn.social/tags/HoloDeck" class="mention hashtag" rel="nofollow noopener noreferrer" target="_blank">#HoloDeck</a> will be used in <a href="https://mstdn.social/tags/biology" class="mention hashtag" rel="nofollow noopener noreferrer" target="_blank">#biology</a> & <a href="https://mstdn.social/tags/chemistry" class="mention hashtag" rel="nofollow noopener noreferrer" target="_blank">#chemistry</a> <a href="https://mstdn.social/tags/teaching" class="mention hashtag" rel="nofollow noopener noreferrer" target="_blank">#teaching</a> <a href="https://mstdn.social/tags/classes" class="mention hashtag" rel="nofollow noopener noreferrer" target="_blank">#classes</a> using <a href="https://mastodon.gamedev.place/@tiltfive" class="u-url mention" rel="nofollow noopener noreferrer" target="_blank">@tiltfive</a> hardware, soon. <a href="https://mstdn.social/tags/DIYbio" class="mention hashtag" rel="nofollow noopener noreferrer" target="_blank">#DIYbio</a> <a href="https://mstdn.social/tags/lab" class="mention hashtag" rel="nofollow noopener noreferrer" target="_blank">#lab</a> <a href="https://mstdn.social/tags/instruments" class="mention hashtag" rel="nofollow noopener noreferrer" target="_blank">#instruments</a> <a href="https://mstdn.social/tags/OpenSource" class="mention hashtag" rel="nofollow noopener noreferrer" target="_blank">#OpenSource</a> <a href="https://mstdn.social/tags/chemistry" class="mention hashtag" rel="nofollow noopener noreferrer" target="_blank">#chemistry</a> <a href="https://mstdn.social/tags/bioinformatics" class="mention hashtag" rel="nofollow noopener noreferrer" target="_blank">#bioinformatics</a> <a href="https://mstdn.social/tags/CompChem" class="mention hashtag" rel="nofollow noopener noreferrer" target="_blank">#CompChem</a> <a href="https://mstdn.social/tags/AugmentedReality" class="mention hashtag" rel="nofollow noopener noreferrer" target="_blank">#AugmentedReality</a> <a href="https://mstdn.social/tags/MINT" class="mention hashtag" rel="nofollow noopener noreferrer" target="_blank">#MINT</a> <a href="https://mstdn.social/tags/STEM" class="mention hashtag" rel="nofollow noopener noreferrer" target="_blank">#STEM</a> <a href="https://mstdn.social/tags/education" class="mention hashtag" rel="nofollow noopener noreferrer" target="_blank">#education</a>

Bose-Einstein-Kondensat3/n Especially <a href="https://mstdn.social/tags/kids" class="mention hashtag" rel="nofollow noopener noreferrer" target="_blank">#kids</a> intuitively understood complex <a href="https://mstdn.social/tags/molecular" class="mention hashtag" rel="nofollow noopener noreferrer" target="_blank">#molecular</a> relationships & had a lot of fun <a href="https://mstdn.social/tags/playing" class="mention hashtag" rel="nofollow noopener noreferrer" target="_blank">#playing</a> with colorful <a href="https://mstdn.social/tags/protein" class="mention hashtag" rel="nofollow noopener noreferrer" target="_blank">#protein</a>, <a href="https://mstdn.social/tags/DNA" class="mention hashtag" rel="nofollow noopener noreferrer" target="_blank">#DNA</a> & <a href="https://mstdn.social/tags/RNA" class="mention hashtag" rel="nofollow noopener noreferrer" target="_blank">#RNA</a> <a href="https://mstdn.social/tags/structures" class="mention hashtag" rel="nofollow noopener noreferrer" target="_blank">#structures</a> making our <a href="https://mstdn.social/tags/AR" class="mention hashtag" rel="nofollow noopener noreferrer" target="_blank">#AR</a> tool a valuable <a href="https://mstdn.social/tags/educational" class="mention hashtag" rel="nofollow noopener noreferrer" target="_blank">#educational</a> companion. <a href="https://mstdn.social/tags/MINT" class="mention hashtag" rel="nofollow noopener noreferrer" target="_blank">#MINT</a> <a href="https://mstdn.social/tags/STEM" class="mention hashtag" rel="nofollow noopener noreferrer" target="_blank">#STEM</a> <a href="https://mstdn.social/tags/school" class="mention hashtag" rel="nofollow noopener noreferrer" target="_blank">#school</a> <a href="https://mstdn.social/tags/education" class="mention hashtag" rel="nofollow noopener noreferrer" target="_blank">#education</a> <a href="https://mstdn.social/tags/OpenSource" class="mention hashtag" rel="nofollow noopener noreferrer" target="_blank">#OpenSource</a> <a href="https://mstdn.social/tags/chem" class="mention hashtag" rel="nofollow noopener noreferrer" target="_blank">#chem</a> <a href="https://mstdn.social/tags/bioinformatics" class="mention hashtag" rel="nofollow noopener noreferrer" target="_blank">#bioinformatics</a> <a href="https://mstdn.social/tags/CompChem" class="mention hashtag" rel="nofollow noopener noreferrer" target="_blank">#CompChem</a> <a href="https://mstdn.social/tags/AugmentedReality" class="mention hashtag" rel="nofollow noopener noreferrer" target="_blank">#AugmentedReality</a>

Bose-Einstein-Kondensat2/n While our <a href="https://mstdn.social/tags/IdeenExpo" class="mention hashtag" rel="nofollow noopener noreferrer" target="_blank">#IdeenExpo</a> presentation from last year just covered <a href="https://mstdn.social/tags/Windows" class="mention hashtag" rel="nofollow noopener noreferrer" target="_blank">#Windows</a> OS, this time we presented the <a href="https://mstdn.social/tags/AR" class="mention hashtag" rel="nofollow noopener noreferrer" target="_blank">#AR</a> molecular visualization system running under <a href="https://mstdn.social/tags/Ubuntu" class="mention hashtag" rel="nofollow noopener noreferrer" target="_blank">#Ubuntu</a> 24.04LTS <a href="https://mstdn.social/tags/Linux" class="mention hashtag" rel="nofollow noopener noreferrer" target="_blank">#Linux</a>. Lots of fun explaining... <a href="https://mstdn.social/tags/DIYbio" class="mention hashtag" rel="nofollow noopener noreferrer" target="_blank">#DIYbio</a> <a href="https://mstdn.social/tags/lab" class="mention hashtag" rel="nofollow noopener noreferrer" target="_blank">#lab</a> <a href="https://mstdn.social/tags/instruments" class="mention hashtag" rel="nofollow noopener noreferrer" target="_blank">#instruments</a> <a href="https://mstdn.social/tags/OpenSource" class="mention hashtag" rel="nofollow noopener noreferrer" target="_blank">#OpenSource</a> <a href="https://mstdn.social/tags/chemistry" class="mention hashtag" rel="nofollow noopener noreferrer" target="_blank">#chemistry</a> <a href="https://mstdn.social/tags/bioinformatics" class="mention hashtag" rel="nofollow noopener noreferrer" target="_blank">#bioinformatics</a> <a href="https://mstdn.social/tags/CompChem" class="mention hashtag" rel="nofollow noopener noreferrer" target="_blank">#CompChem</a> <a href="https://mstdn.social/tags/AugmentedReality" class="mention hashtag" rel="nofollow noopener noreferrer" target="_blank">#AugmentedReality</a>

Bose-Einstein-Kondensat1/n Proud to present the next <a href="https://mstdn.social/tags/prototype" class="mention hashtag" rel="nofollow noopener noreferrer" target="_blank">#prototype</a> development round of our Rechenkraft.net <a href="https://mstdn.social/tags/Molecular" class="mention hashtag" rel="nofollow noopener noreferrer" target="_blank">#Molecular</a> <a href="https://mstdn.social/tags/AR" class="mention hashtag" rel="nofollow noopener noreferrer" target="_blank">#AR</a> Environment at <a href="https://mstdn.social/tags/CLT2025" class="mention hashtag" rel="nofollow noopener noreferrer" target="_blank">#CLT2025</a> (March 22/23rd): An <a href="https://mstdn.social/tags/OpenSource" class="mention hashtag" rel="nofollow noopener noreferrer" target="_blank">#OpenSource</a> approach based on the @tiltfive.bsky.social hardware to visualize <a href="https://mstdn.social/tags/molecular" class="mention hashtag" rel="nofollow noopener noreferrer" target="_blank">#molecular</a> structures in <a href="https://mstdn.social/tags/3D" class="mention hashtag" rel="nofollow noopener noreferrer" target="_blank">#3D</a>. <a href="https://mstdn.social/tags/DIYbio" class="mention hashtag" rel="nofollow noopener noreferrer" target="_blank">#DIYbio</a> <a href="https://mstdn.social/tags/lab" class="mention hashtag" rel="nofollow noopener noreferrer" target="_blank">#lab</a> <a href="https://mstdn.social/tags/instruments" class="mention hashtag" rel="nofollow noopener noreferrer" target="_blank">#instruments</a> <a href="https://mstdn.social/tags/bioinformatics" class="mention hashtag" rel="nofollow noopener noreferrer" target="_blank">#bioinformatics</a> <a href="https://mstdn.social/tags/CompChem" class="mention hashtag" rel="nofollow noopener noreferrer" target="_blank">#CompChem</a>

Andrés Manuel ÁlvarezIf you are curious about the work, you can check it in the following link 🤓 : <a href="https://doi.org/10.1002/anie.202407813" rel="nofollow noopener noreferrer" translate="no" target="_blank">https://doi.org/10.1002/anie.202407813</a><a href="https://mastodon.social/tags/chemistry" class="mention hashtag" rel="nofollow noopener noreferrer" target="_blank">#chemistry</a> <a href="https://mastodon.social/tags/OrgChem" class="mention hashtag" rel="nofollow noopener noreferrer" target="_blank">#OrgChem</a> <a href="https://mastodon.social/tags/Catalysis" class="mention hashtag" rel="nofollow noopener noreferrer" target="_blank">#Catalysis</a> <a href="https://mastodon.social/tags/CompChem" class="mention hashtag" rel="nofollow noopener noreferrer" target="_blank">#CompChem</a> <a href="https://mastodon.social/tags/science" class="mention hashtag" rel="nofollow noopener noreferrer" target="_blank">#science</a> <a href="https://mastodon.social/tags/research" class="mention hashtag" rel="nofollow noopener noreferrer" target="_blank">#research</a>

Piia BartosI like how the random placement of ions made me a nice cluster of sodium. Wonder why they don't want to stick together and the simulation keeps exploding...<a href="https://mastodontti.fi/tags/compchem" class="mention hashtag" rel="nofollow noopener noreferrer" target="_blank">#compchem</a> <a href="https://mastodontti.fi/tags/ThereIsYourProblem" class="mention hashtag" rel="nofollow noopener noreferrer" target="_blank">#ThereIsYourProblem</a> <a href="https://mastodontti.fi/tags/science" class="mention hashtag" rel="nofollow noopener noreferrer" target="_blank">#science</a> <a href="https://mastodontti.fi/tags/chemistry" class="mention hashtag" rel="nofollow noopener noreferrer" target="_blank">#chemistry</a> <a href="https://mastodontti.fi/tags/simulation" class="mention hashtag" rel="nofollow noopener noreferrer" target="_blank">#simulation</a>

Robert Pollice<a href="https://mstdn.science/tags/RobSelects" class="mention hashtag" rel="nofollow noopener noreferrer" target="_blank">#RobSelects</a> paper of the week <a href="https://mstdn.science/tags/JCTC" class="mention hashtag" rel="nofollow noopener noreferrer" target="_blank">#JCTC</a>: Domain-Based Local Pair Natural Orbital-Random Phase Approximation implementation provides accurate correlation energies at a significantly reduced scaling. <a href="https://mstdn.science/tags/compchem" class="mention hashtag" rel="nofollow noopener noreferrer" target="_blank">#compchem</a> <a href="https://doi.org/10.1021/acs.jctc.4c01540" rel="nofollow noopener noreferrer" translate="no" target="_blank">https://doi.org/10.1021/acs.jctc.4c01540</a>

Robert Pollice<a href="https://mstdn.science/tags/RobSelects" class="mention hashtag" rel="nofollow noopener noreferrer" target="_blank">#RobSelects</a> preprint of the week <a href="https://mstdn.science/tags/ChemRxiv" class="mention hashtag" rel="nofollow noopener noreferrer" target="_blank">#ChemRxiv</a>: Efficient and accurate model for atomic partial charges combining electronegativity equilibration with the bond-capacity model. <a href="https://mstdn.science/tags/compchem" class="mention hashtag" rel="nofollow noopener noreferrer" target="_blank">#compchem</a> <a href="https://doi.org/10.26434/chemrxiv-2025-1nxwg" rel="nofollow noopener noreferrer" translate="no" target="_blank">https://doi.org/10.26434/chemrxiv-2025-1nxwg</a>

Robert Pollice<a href="https://mstdn.science/tags/RobSelects" class="mention hashtag" rel="nofollow noopener noreferrer" target="_blank">#RobSelects</a> paper of the week <a href="https://mstdn.science/tags/JCTC" class="mention hashtag" rel="nofollow noopener noreferrer" target="_blank">#JCTC</a>: Investigating CCSD(T) overbinding in pi-complexes through systematic scaling with system size. <a href="https://mstdn.science/tags/compchem" class="mention hashtag" rel="nofollow noopener noreferrer" target="_blank">#compchem</a> <a href="https://doi.org/10.1021/acs.jctc.4c01512" rel="nofollow noopener noreferrer" translate="no" target="_blank">https://doi.org/10.1021/acs.jctc.4c01512</a>

Robert Pollice<a href="https://mstdn.science/tags/RobSelects" class="mention hashtag" rel="nofollow noopener noreferrer" target="_blank">#RobSelects</a> preprint of the week <a href="https://mstdn.science/tags/ChemRxiv" class="mention hashtag" rel="nofollow noopener noreferrer" target="_blank">#ChemRxiv</a>: Modified independent gradient model approach for revealing non-covalent interactions based on promolecular densities. <a href="https://mstdn.science/tags/compchem" class="mention hashtag" rel="nofollow noopener noreferrer" target="_blank">#compchem</a> <a href="https://doi.org/10.26434/chemrxiv-2025-zts13" rel="nofollow noopener noreferrer" translate="no" target="_blank">https://doi.org/10.26434/chemrxiv-2025-zts13</a>

Robert Pollice<a href="https://mstdn.science/tags/RobSelects" class="mention hashtag" rel="nofollow noopener noreferrer" target="_blank">#RobSelects</a> preprint of the week <a href="https://mstdn.science/tags/ChemRxiv" class="mention hashtag" rel="nofollow noopener noreferrer" target="_blank">#ChemRxiv</a>: Systematic computational chemistry benchmark for highly strained conformations. <a href="https://mstdn.science/tags/compchem" class="mention hashtag" rel="nofollow noopener noreferrer" target="_blank">#compchem</a> <a href="https://doi.org/10.26434/chemrxiv-2025-4mbsk-v2" rel="nofollow noopener noreferrer" translate="no" target="_blank">https://doi.org/10.26434/chemrxiv-2025-4mbsk-v2</a>

Robert Pollice<a href="https://mstdn.science/tags/RobSelects" class="mention hashtag" rel="nofollow noopener noreferrer" target="_blank">#RobSelects</a> preprint of the week <a href="https://mstdn.science/tags/ChemRxiv" class="mention hashtag" rel="nofollow noopener noreferrer" target="_blank">#ChemRxiv</a>: High-throughput virtual screening of regioselectivity for directed concerted metalationdeprotonation. <a href="https://mstdn.science/tags/compchem" class="mention hashtag" rel="nofollow noopener noreferrer" target="_blank">#compchem</a> <a href="https://doi.org/10.26434/chemrxiv-2025-vssxt" rel="nofollow noopener noreferrer" translate="no" target="_blank">https://doi.org/10.26434/chemrxiv-2025-vssxt</a>

NMR Online LimitedOur first big news of 2025:TRADEMARKTo protect our name and identity, we have successfully trademarked our brand.From today, you will find our logo on all of our output (website, software, posters, webinars, etc.), so you can be sure it's authentic.<a href="https://mstdn.science/tags/bioinformatics" class="mention hashtag" rel="nofollow noopener noreferrer" target="_blank">#bioinformatics</a> <a href="https://mstdn.science/tags/biology" class="mention hashtag" rel="nofollow noopener noreferrer" target="_blank">#biology</a> <a href="https://mstdn.science/tags/biochemistry" class="mention hashtag" rel="nofollow noopener noreferrer" target="_blank">#biochemistry</a> <a href="https://mstdn.science/tags/biophysics" class="mention hashtag" rel="nofollow noopener noreferrer" target="_blank">#biophysics</a> <a href="https://mstdn.science/tags/chemistry" class="mention hashtag" rel="nofollow noopener noreferrer" target="_blank">#chemistry</a> <a href="https://mstdn.science/tags/CompChem" class="mention hashtag" rel="nofollow noopener noreferrer" target="_blank">#CompChem</a> <a href="https://mstdn.science/tags/metabolomics" class="mention hashtag" rel="nofollow noopener noreferrer" target="_blank">#metabolomics</a> <a href="https://mstdn.science/tags/NMR" class="mention hashtag" rel="nofollow noopener noreferrer" target="_blank">#NMR</a> <a href="https://mstdn.science/tags/NMRChat" class="mention hashtag" rel="nofollow noopener noreferrer" target="_blank">#NMRChat</a> <a href="https://mstdn.science/tags/NMROnline" class="mention hashtag" rel="nofollow noopener noreferrer" target="_blank">#NMROnline</a> <a href="https://mstdn.science/tags/physics" class="mention hashtag" rel="nofollow noopener noreferrer" target="_blank">#physics</a> <a href="https://mstdn.science/tags/spectroscopy" class="mention hashtag" rel="nofollow noopener noreferrer" target="_blank">#spectroscopy</a> <a href="https://mstdn.science/tags/StructuralBiology" class="mention hashtag" rel="nofollow noopener noreferrer" target="_blank">#StructuralBiology</a>

Robert Pollice<a href="https://mstdn.science/tags/RobSelects" class="mention hashtag" rel="nofollow noopener noreferrer" target="_blank">#RobSelects</a> preprint of the week <a href="https://mstdn.science/tags/ChemRxiv" class="mention hashtag" rel="nofollow noopener noreferrer" target="_blank">#ChemRxiv</a>: A general purpose machine learning potential for organic chemistry <a href="https://mstdn.science/tags/compchem" class="mention hashtag" rel="nofollow noopener noreferrer" target="_blank">#compchem</a> <a href="https://doi.org/10.26434/chemrxiv-2023-296ch-v3" rel="nofollow noopener noreferrer" translate="no" target="_blank">https://doi.org/10.26434/chemrxiv-2023-296ch-v3</a>

Recent searches

Search options

Administered by:

Server stats:

#CompChem