lp:~ptoolsdev/ptools/APBS_interface

Created by Adrien Saladin and last modified
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Owner:
PTools dev team
Project:
PTools
Status:
Development

Recent revisions

246. By sfiorucci

fix problem with unsigned int

245. By asaladin

fix to compile APBS version with g++-4.3

244. By sfiorucci

backup some of my last modifications in branch APBS_interface

243. By sfiorucci

modif the patch cutoff value in APBS_interface

242. By sfiorucci

APBS branch: normalize desolvation energy and save few test scripts

241. By sfiorucci

remove useless output in Desol_Resbased.py and correct format in Elec_patch.py

240. By sfiorucci

uncomplete commit : forget pdbio.cpp in commit 431

239. By sfiorucci

bug fix: read atom number in pdbio.cpp
bug fix: bad output format in write_probe_solv_pqr.py
add HID amber atom type in reduce2.py
modify Desolv_Resbased.py
normalize Electrostatic contribution of the solvation energy in Elec_patch.py

238. By sfiorucci

fix incomplete branch creation. (surface functions and surfpoint.py script)

237. By sfiorucci

add detection of possible binding site

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