Binding of carboxylate and trimethylammonium salts to octa-acid and TEMOA deep-cavity cavitands.
about
Overview of the SAMPL5 host-guest challenge: Are we doing better?Predicting Binding Free Energies: Frontiers and Benchmarks.The SAMPL5 host-guest challenge: computing binding free energies and enthalpies from explicit solvent simulations by the attach-pull-release (APR) method.Tuning the Binding Dynamics of a Guest-Octaacid Capsule through Noncovalent Anchoring.A combined treatment of hydration and dynamical effects for the modeling of host-guest binding thermodynamics: the SAMPL5 blinded challenge.
P2860
Binding of carboxylate and trimethylammonium salts to octa-acid and TEMOA deep-cavity cavitands.
description
2016 nî lūn-bûn
@nan
2016年の論文
@ja
2016年論文
@yue
2016年論文
@zh-hant
2016年論文
@zh-hk
2016年論文
@zh-mo
2016年論文
@zh-tw
2016年论文
@wuu
2016年论文
@zh
2016年论文
@zh-cn
name
Binding of carboxylate and tri ...... d TEMOA deep-cavity cavitands.
@en
type
label
Binding of carboxylate and tri ...... d TEMOA deep-cavity cavitands.
@en
prefLabel
Binding of carboxylate and tri ...... d TEMOA deep-cavity cavitands.
@en
P2093
P2860
P1476
Binding of carboxylate and tri ...... d TEMOA deep-cavity cavitands.
@en
P2093
James P Donahue
Matthew R Sullivan
Punidha Sokkalingam
Thong Nguyen
P2860
P2888
P356
10.1007/S10822-016-9925-0
P577
2016-07-18T00:00:00Z
P6179
1041431762