ligpargen

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Local Version of LigParGen lacks some Improper Dihedral parameters

1

- [x] I believe this to be a bug with LigParGen - [ ] This is a feature request ## Issue Information Software name & Version : LigParGen in conda...

wutobias

requesting meaningful OPLSAA atom types in output files

10

- [ ] I believe this to be a bug with LigParGen - [x] This is a feature request ## Issue Information Software name & Version : http://zarbi.chem.yale.edu/ligpargen/ Method: Not...

jewettaij

Problem of installing LigParGen Server Locally

3

- [x] I believe this to be a bug with LigParGen - [x] This is a feature request ## Issue Information Software name & Version : LigParGen Method: ## Actual...

sbkk000

command line is always looking for .mol, independent of options and crashes if not found

2

Hi! I think there is a bug in LigGenPar 2.3 command line I have installed it as advised, liked BOSS, etc.. when I do a test with smiles I get...

punkpony

Further to my previous issue on Glycerol MD simulation, I would like to inform you about what follows. 1) OPLS-AA FF Atom partial charges from LigParGen Output: C1 | -0.0315...

paolobotto

Hi, I want to build a slab made of Glycerol molecules to be used as substrate for Langmuir-Blodgett simulations. Glycerol data were obtained from LigParGen site. Multiple molecules data were...

paolobotto

- [x] I believe this to be a bug with LigParGen - [] This is a feature request ## Issue Information I'm trying to generate opls-aa topology for cellulose chain....

arashelahi

- [√] I believe this to be a bug with LigParGen - [ ] This is a feature request ## Issue Information Software name & Version : LigParGen online Generator...

Smile098

- [x] I believe this to be a bug with LigParGen - [ ] This is a feature request ## Issue Information Software name & Version : Current online version...

chem-william

- [x] I believe this to be a bug with LigParGen ## Issue Information Software name & Version : LigParGen online Generator Method: FF generation by SMILE input of fully...

rcruzsilva