Topic: free-energies Goto Github
Some thing interesting about free-energies
Some thing interesting about free-energies
free-energies,Dynamic Histogram Analysis To Determine Free Energies and Rates from Biased Simulations
Organization: bio-phys
free-energies,Python implementation of the multistate Bennett acceptance ratio (MBAR)
Organization: choderalab
Home Page: http://pymbar.readthedocs.io
free-energies,Ion solvation free energy with spherical boundary conditions
User: jeff231li
free-energies,Binless weighted histogram analysis method (WHAM) aka multi-state Bennet acceptance ratio (MBAR) with the ability to combine umbrella sampling simulations with different restraints and project onto reaction coordinates other than ones sampled at
User: jjgoings
free-energies,Experimental and calculated small molecule hydration free energies
Organization: mobleylab
Home Page: http://www.escholarship.org/uc/item/6sd403pz
free-energies,Experimental small molecule hydration free energy dataset
Organization: mobleylab
free-energies,Full automation of relative protein-ligand binding free energy calculations in GROMACS
Organization: protocaller
Home Page: http://protocaller.readthedocs.io
free-energies,Resistors can now be negative ohms and reciprocal (Mho's Law): Current equals Resistance divided by Voltage. Expanded coupling coefficient on transformers. Added scientific notation spanning 10e48. BTW, William Lyne says that the electromagnetic force is 10e40 times greater than the gravitational force in his book: Occult Ether Physics.
User: vinyasi
Home Page: http://vinyasi.info/circuitjs1/!_zipped-files/
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