Projects: pypi: alchemical
https://packages.ecosyste.ms/registries/pypi.org/packages/alchemical
Modern SQLAlchemy simplified
11 versions
Latest release: over 1 year ago
2,705 downloads last month
Enhanced Analysis
Repository Activity:
Repository Owner:
Miguel Grinberg (user)
README Analysis:
Science Score: 40/100
Starting Score: 100 points
Penalties:
-
-10
PyPI ecosystem
General-purpose ecosystem -
-15
No science keywords
No scientific terms found in keywords/classifiers -
-10
No science terms in description
No scientific terms found in description -
-25
Non-science indicators
1 non-scientific terms found
Likely Science (40)
Papers Mentioning alchemical 5
10.1371/journal.pcbi.1008807
Membrane-binding mechanism of the EEA1 FYVE domain revealed by multi-scale molecular dynamics simulationsCited by: 7
Author(s): Andreas Haahr Larsen, Lilya Tata, Laura John, Mark S. P. Sansom
Software Mentions: 6
Published: almost 4 years ago
10.1126/sciadv.abh2217
Identification and assessment of cardiolipin interactions with <i>E. coli</i> inner membrane proteinsCited by: 33
Author(s): Robin A. Corey, Wanling Song, Anna L. Duncan, T. Bertie Ansell, Mark S. P. Sansom, Phillip J. Stansfeld
Software Mentions: 4
Published: almost 4 years ago
10.1016/j.bpj.2019.07.056
Proton Control of Transitions in an Amino Acid TransporterCited by: 10
Author(s): Zhiyi Wu, Irfan Alibay, Simon Newstead, Philip C. Biggin
Software Mentions: 3
Published: almost 6 years ago
10.7717/peerj-cs.264
Implementation of adaptive integration method for free energy calculations in molecular systemsCited by: 0
Author(s): Christopher A. Mirabzadeh, F. Marty Ytreberg
Software Mentions: 2
Published: over 5 years ago
10.1021/acs.jpcb.1c05303
Transferable Ion Force Fields in Water from a Simultaneous Optimization of Ion Solvation and Ion–Ion InteractionCited by: 26
Author(s): Philip Loche, P. Steinbrunner, Sean Friedowitz, Roland R. Netz, Douwe Jan Bonthuis
Software Mentions: 1
Published: about 4 years ago