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Application

Discovery Studio 1.0 Materials Studio 0.9744192352888005 Solvation Chemistry 0.0

Modules

Adsorption Locator 0.06482905477345322 Amorphous Cell 0.2756417839820182 Blends 0.00224772270199929 CASTEP 0.37040104105051463 CDOCKER 0.16680468472731574 CHARMm 0.26404826688749555 COMPASS 0.3531290666035727 COMPASS III 0.0895540044954454 COSMObase 0.003903939429788241 COSMOconf 0.004850348988524784 COSMOmic 1.183011948420679E-4 COSMOperm 0.001183011948420679 COSMOplex 2.366023896841358E-4 COSMOquick 0.0015379155329468827 COSMOtherm 0.064474151188927 Catalyst 0.11546196616585827 Classical Simulations 1.0 Conformers 3.549035845262037E-4 Crystallization 0.07157222287945109 DFTB Plus 0.005678457352419259 DMol3 0.16834260026026263 DPD 0.0020111203123151546 Discover 0.0030758310658937655 Forcite 0.5308174612563586 GULP 0.022122323435466697 Kinetix 2.366023896841358E-4 LUDI 0.0033124334555779014 LibDock 0.07145392168460901 LigandFit 0.004968650183366852 MCSS 4.732047793682716E-4 MODELER 0.20962971726014432 MesoDyn 8.281083638944754E-4 Mesocite 0.0031941322607358332 Mesoscale 0.005796758547261327 Modules 0.0 Morphology 0.016798769667573644 ONETEP 8.281083638944754E-4 Polymorph 0.0020111203123151546 QMERA 1.183011948420679E-4 QSAR 9.464095587365432E-4 Quantum Mechanics 0.5270318230214125 Reflex 0.05193422453566781 Reflex Plus 0.0010647107535786111 Semi-empirical 0.007452975275050278 Sorption 0.05583816396545605 Synthia 0.0016562167277889507 TURBOMOLE 4.732047793682716E-4 VAMP 0.0014196143381048148 Visualization 0.8232580149059505 X-Cell 0.0014196143381048148 ZDOCK 0.02933869632083284

Year

2022 0.052342138858882455 2023 0.2542472748698812 2024 0.582441323774919 2025 1.0 2026 0.41736227045075125 2027 0.0

Keywords

target 1.0 potential 0.29091383812010446 docking 0.22945169712793734 visualization 0.20496083550913838 analysis 0.20151436031331593 between 0.1554046997389034 novel 0.10595300261096606 energy 0.0852219321148825 binding 0.0781201044386423 promising 0.06840731070496084 cell 0.06391644908616188 activity 0.05780678851174935 stability 0.04052219321148825 interaction 0.033838120104438645 synthesized 0.030861618798955614 performance 0.030704960835509137 experimental 0.02762402088772846 development 0.02234986945169713 effective 0.02151436031331593 including 0.0212532637075718 protein 0.020678851174934725 mechanism 0.020261096605744124 synthesis 0.013524804177545691 design 0.0040208877284595304 enhanced 0.0
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