Projects: pypi: AdaptivePELE
https://packages.ecosyste.ms/registries/pypi.org/packages/AdaptivePELE
Enhanced sampling of molecular simulations
8 versions
Latest release: over 2 years ago
148 downloads last month
Enhanced Analysis
Educational Contributors:
alexis.molina@alum.esci.upf.edu
Repository Activity:
Repository Owner:
Electronic and Atomic Protein Modeling (EAPM-BSC) (organization)
README Analysis:
DOI Found
Science Score: 100/100
Starting Score: 100 points
Bonuses:
-
+20
Educational commit emails
1 contributors with educational email addresses -
+14
Science terms in README
7 scientific terms found in README -
+10
DOI references
1 DOI references found in README -
+6
Academic links
1 academic links found in README
Penalties:
-
-10
PyPI ecosystem
General-purpose ecosystem
Very Likely Science (100)
Papers Mentioning AdaptivePELE 1
10.3389/fmolb.2020.599298
Known Evolutionary Paths Are Accessible to Engineered ß-Lactamases Having Altered Protein Motions at the Timescale of Catalytic TurnoverCited by: 3
Author(s): Lorea Alejaldre, Claudèle Lemay-St-Denis, Carles Perez‐Lopez, Ferran Sancho Jodar, Vı́ctor Guallar, Joelle N. Pelletier
Software Mentions: 1
Published: over 5 years ago