S

sire

Settings | Report Duplicate

1

I Use This!

Activity Not Available

Commits : Listings

Analyzed about 1 year ago. based on code collected over 4 years ago.

Commit Message	Contributor	Files Modified	Lines Added	Lines Removed	Code Location	Date
Sep 24, 2019 — Sep 24, 2020 Showing page 400 of 405 Search / Filter on:
replaced plumed.dat with something that makes sense	Giovanni Bussi	More...				over 13 years ago
Again fixes for AIX	Giovanni Bussi	More...				over 13 years ago
Add a flag to store and manipulate derivatives on the grid also when not using splines	Max Bonomi	More...				over 13 years ago
getWords re-written with strtok_r	Giovanni Bussi	More...				over 13 years ago
Fixed bugs. It seems to be working. Methods to read and write from file are still missing. And probably needs optimization (inline stuff?)	Max Bonomi	More...				over 13 years ago
Having a separate class for Spline was a real mess. I switched back to having Grid and SparseGrid class and a flag dospline	Max Bonomi	More...				over 13 years ago
Small cleanup	Giovanni Bussi	More...				over 13 years ago
Two new classes: GridWithSpline (inherits from Grid) to use cubic splines (from plumed1 at this time). At variance with Grid, an additional vector<double> containing derivatives should be provided when using the methods addValue and setValue. The method getValue can be called with or without requesting derivatives. The second class SparseGridWithSpline inherits from SparseGrid and implements the splines in an analogous manner.	Max Bonomi	More...				over 13 years ago
Fixed header line for DUMPDERIVATIVES	Giovanni Bussi	More...				over 13 years ago
Forbidding use of multiple values with unnamed values	Giovanni Bussi	More...				over 13 years ago
Separated interface for cmd()	Giovanni Bussi	More...				over 13 years ago
Several fixes for AIX	Giovanni Bussi	More...				over 13 years ago
Cleanup in Units	Giovanni Bussi	More...				over 13 years ago
Generalized << operator for ActionRegister	Giovanni Bussi	More...				over 13 years ago
Fixed name of Units into SetupUnits	Giovanni Bussi	More...				over 13 years ago
Bug fix	Giovanni Bussi	More...				over 13 years ago
Bug fix	Giovanni Bussi	More...				over 13 years ago
Added debug option to log requested atoms	Giovanni Bussi	More...				over 13 years ago
Fixed a wrong assert()	Giovanni Bussi	More...				over 13 years ago
Group implementation	Giovanni Bussi	More...				over 13 years ago
Added locking/unlocking of requests	Giovanni Bussi	More...				over 13 years ago
Added a debug hidden option PRINT _ROTATE	Giovanni Bussi	More...				over 13 years ago
Functions to dynamically request arguments	Giovanni Bussi	More...				over 13 years ago
requestAtoms is now called only during preparation	Giovanni Bussi	More...				over 13 years ago
Bug fix plumed was crashing in case of empty neighbor list	Giovanni Bussi	More...				over 13 years ago
Added cell info to .xyz dumped by DUMPATOMS	Giovanni Bussi	More...				over 13 years ago
Added tools to access to box	Giovanni Bussi	More...				over 13 years ago
fixes in doc	Giovanni Bussi	More...				over 13 years ago
Small cleanup in WholeMolecules	Giovanni Bussi	More...				over 13 years ago
Small cleanup	Giovanni Bussi	More...				over 13 years ago

←
1
2
…
396
397
398
399
400
401
402
403
404
405
→