Chi Kit Ng
@chikitng.bsky.social
👨💻PhD candidate in the Cole Group @colegroupncl.bsky.social
💊Structure-based & Computational Drug Discovery
📍Newcastle University, Newcastle upon Tyne, UK
💊Structure-based & Computational Drug Discovery
📍Newcastle University, Newcastle upon Tyne, UK
Reposted by Chi Kit Ng
If you're at #ukqsar today, be sure to check out posters by @finlayclark.bsky.social, on work with @openforcefield.org, and @asmaferiel.bsky.social & @chikitng.bsky.social on computer-aided drug design methods! #compchem
November 13, 2025 at 10:34 AM
If you're at #ukqsar today, be sure to check out posters by @finlayclark.bsky.social, on work with @openforcefield.org, and @asmaferiel.bsky.social & @chikitng.bsky.social on computer-aided drug design methods! #compchem
Reposted by Chi Kit Ng
As we approach the end of the first week of the 2025 #CCP5 Summer School in Newcastle, here are a few highlights! Students have had in-depth seminars and practical sessions on computational methods, and guest research seminars to illustrate their use in modern research.... #compchem
July 25, 2025 at 1:30 PM
Reposted by Chi Kit Ng
July 21, 2025 at 9:53 AM
Reposted by Chi Kit Ng
Big update to @jhmchem.bsky.social's preprint on "Computing solvation free energies of small molecules with first principles accuracy" now available on arXiv: arxiv.org/abs/2405.181... #compchem 🧵
Computing hydration free energies of small molecules with first principles accuracy
Free energies play a central role in characterising the behaviour of chemical systems and are among the most important quantities that can be calculated by molecular dynamics simulations. The free ene...
arxiv.org
July 1, 2025 at 10:51 AM
Big update to @jhmchem.bsky.social's preprint on "Computing solvation free energies of small molecules with first principles accuracy" now available on arXiv: arxiv.org/abs/2405.181... #compchem 🧵