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Approximate solvation free energy calculator
Brought to you by:
drmaruyama
,
e1kojima
,
kenkasa
,
nbykmtb
,
ssakuraba
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46
gen_structure for NAMD cannot accept solute spanning multiple molecule
2.0
open
Shun Sakuraba
2019-06-25
2023-01-10
45
gen_structure for NAMD combines multiple solutes into one
2.0
open
Shun Sakuraba
2019-06-25
2023-01-10
44
gen_structure for NAMD incorrectly splits solvent into solute and the solvent
2.0
open
Shun Sakuraba
2016-12-20
2023-01-10
40
Automatically determine the energy mesh
2.0
open
2015-07-29
2023-01-10
33
Add read-ahead to vmdfio
2.0
open
Shun Sakuraba
2014-11-16
2023-01-10
31
Implement LJ-PME
2.0
open
Shun Sakuraba
2014-04-02
2023-01-10
29
Rewrite reciprocal kernel
2.0
open
Shun Sakuraba
2013-11-28
2023-01-10
28
Completely rewrite real-space kernel
2.0
open
Shun Sakuraba
2013-11-28
2023-01-10
27
Completely rewrite real-space and reciprocal-space kernels
2.0
open
Shun Sakuraba
2013-11-28
2023-01-10
2
Add semi-automatic EcdInfo generator
2.0
open
2012-05-02
2023-01-10
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