Application of MDGRAPE-3, a special purpose board for molecular dynamics simulations, to periodic biomolecular systems.
about
Enhanced conformational sampling to visualize a free-energy landscape of protein complex formationAll-atom molecular dynamics analysis of multi-peptide systems reproduces peptide solubility in line with experimental observationsClassical electrostatics for biomolecular simulations.Non-Ewald methods: theory and applications to molecular systems.Enhanced sampling simulations to construct free-energy landscape of protein-partner substrate interaction.Human aquaporin 4 gating dynamics under and after nanosecond-scale static and alternating electric-field impulses: a molecular dynamics study of field effects and relaxation.Simple and accurate scheme to compute electrostatic interaction: zero-dipole summation technique for molecular system and application to bulk water.Molecular dynamics scheme for precise estimation of electrostatic interaction via zero-dipole summation principle.Algorithm improvements for molecular dynamics simulationsA long-range electrostatic potential based on the Wolf method charge-neutral condition
P2860
Q26747086-3DB297FD-6754-4053-92E7-AE9773728E67Q36512184-651F04E1-2955-4F99-A941-EE7E8981BA8FQ37626128-F3245D93-488C-4ACE-B5E6-C896507484D9Q38072043-CCCDC380-78C1-4067-AFCE-FB79732B683CQ39310722-E703C7A9-97C1-422F-98C0-3CDA384F82DCQ44270711-807529F5-3447-4220-B276-C6E8AA655725Q51333111-1B5265AB-E8F1-4DAE-B9B7-18D64691F3C2Q51574046-97CE7A4E-F916-4F7A-B7DD-86103A28B625Q57082058-EFF2CA20-EDC4-4502-ACC4-3060F530F6A5Q57127256-30A589FF-32AD-4C66-93AA-33BAC06B28B0
P2860
Application of MDGRAPE-3, a special purpose board for molecular dynamics simulations, to periodic biomolecular systems.
description
2009 nî lūn-bûn
@nan
2009年の論文
@ja
2009年学术文章
@wuu
2009年学术文章
@zh
2009年学术文章
@zh-cn
2009年学术文章
@zh-hans
2009年学术文章
@zh-my
2009年学术文章
@zh-sg
2009年學術文章
@yue
2009年學術文章
@zh-hant
name
Application of MDGRAPE-3, a sp ...... periodic biomolecular systems.
@en
Application of MDGRAPE-3, a sp ...... periodic biomolecular systems.
@nl
type
label
Application of MDGRAPE-3, a sp ...... periodic biomolecular systems.
@en
Application of MDGRAPE-3, a sp ...... periodic biomolecular systems.
@nl
prefLabel
Application of MDGRAPE-3, a sp ...... periodic biomolecular systems.
@en
Application of MDGRAPE-3, a sp ...... periodic biomolecular systems.
@nl
P2093
P356
P1476
Application of MDGRAPE-3, a sp ...... periodic biomolecular systems.
@en
P2093
Gota Kikugawa
Narutoshi Kamiya
Rossen Apostolov
Ryutaro Himeno
Yasushige Yonezawa
P304
P356
10.1002/JCC.21035
P577
2009-01-01T00:00:00Z