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Application

Discovery Studio 0.9430268951249271 Materials Studio 1.0 Solvation Chemistry 0.0

Modules

Adsorption Locator 0.06926751592356688 Amorphous Cell 0.2812680949623625 Blends 0.0031847133757961785 CASTEP 0.424145917776491 CDOCKER 0.16748697162709902 CHARMm 0.2461638679791546 COMPASS 0.381658946149392 COMPASS III 0.07223508975101332 COSMObase 0.0028951939779965257 COSMOconf 0.0032570932252460913 COSMOmic 2.1713954834973943E-4 COSMOperm 0.0013028372900984366 COSMOplex 3.618992472495657E-4 COSMOquick 0.001519976838448176 COSMOtherm 0.06543138390272148 Cantera 7.237984944991314E-5 Catalyst 0.11653155761436017 Classical Simulations 1.0 Conformers 0.0014475969889982628 Crystallization 0.07693977996525768 DFTB Plus 0.0058627678054429646 DMol3 0.19528083381586567 DPD 0.0031847133757961785 Discover 0.0052113491603937466 Forcite 0.5411841343370006 GULP 0.027721482339316733 Kinetix 2.1713954834973943E-4 LUDI 0.0055008685581933985 LibDock 0.06781991893456861 LigandFit 0.007455124493341054 MCSS 0.0013752171395483496 MODELER 0.18015344528083382 MesoDyn 0.0016647365373480022 Mesocite 0.004777070063694267 Mesoscale 0.008468442385639837 Modules 0.0 Morphology 0.017877822814128547 ONETEP 0.0011580775911986102 Polymorph 0.002026635784597568 QMERA 2.1713954834973943E-4 QSAR 0.0013752171395483496 Quantum Mechanics 0.606615518239722 Reflex 0.05660104226983208 Reflex Plus 7.237984944991314E-4 Semi-empirical 0.007961783439490446 Sorption 0.054067747539085116 Synthia 0.0013752171395483496 TURBOMOLE 5.790387955993051E-4 VAMP 0.0017371163867979154 Visualization 0.8417776491024899 X-Cell 0.0011580775911986102 ZDOCK 0.029096699478865083

Year

2020 0.03980945899965975 2021 0.15770670296019054 2022 0.2903198366791426 2023 0.5238176250425315 2024 1.0 2025 0.9727798570942497 2026 0.361602585913576 2027 0.0

Keywords

target 1.0 potential 0.25154982574098633 docking 0.2014619251765722 visualization 0.19945717546186348 analysis 0.17160657557906425 between 0.15316287820374425 novel 0.09517934799370817 energy 0.08629676464238349 binding 0.0614995527866021 cell 0.05795268790673287 activity 0.04592418961848071 promising 0.040958578786663785 interaction 0.03805940227616198 experimental 0.03062640718008821 synthesized 0.026339327020941924 stability 0.025475742528452024 mechanism 0.017302532153101194 performance 0.016377263054004873 effective 0.015112728618573235 protein 0.012768713567529223 development 0.012676186657619591 synthesis 0.008296579588563674 including 0.0050581377417265524 chemical 0.0034543379699595966 design 0.0
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