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Application

Discovery Studio 1.0 Materials Studio 0.982369702006411 Solvation Chemistry 0.0

Modules

Adsorption Locator 0.06699791633274563 Amorphous Cell 0.2779291553133515 Blends 0.0025645135438371533 CASTEP 0.404471870492066 CDOCKER 0.17663087033178393 CHARMm 0.2599775605064914 COMPASS 0.36760698829940697 COMPASS III 0.07597371373617567 COSMObase 0.0030453598333066195 COSMOconf 0.003446065074531175 COSMOmic 1.6028209648982208E-4 COSMOperm 0.0012822567719185766 COSMOplex 2.4042314473473312E-4 COSMOquick 0.0012021157236736656 COSMOtherm 0.06331142811347973 Cantera 8.014104824491104E-5 Catalyst 0.12357749639365283 Classical Simulations 1.0 Conformers 0.0012021157236736656 Crystallization 0.07453117486776727 DFTB Plus 0.00617086071485815 DMol3 0.18464497515627504 DPD 0.0028850777368167975 Discover 0.004407757653470107 Forcite 0.5327776887321686 GULP 0.026206122776085913 Kinetix 2.4042314473473312E-4 LUDI 0.005609873377143773 LibDock 0.07148581503446065 LigandFit 0.007132553293797083 MCSS 0.0013623978201634877 MODELER 0.18680878345888766 MesoDyn 0.001763103061388043 Mesocite 0.0040070524122455525 Mesoscale 0.00769354063151146 Modules 0.0 Morphology 0.017711171662125342 ONETEP 8.815515306940214E-4 Polymorph 0.001843244109632954 QMERA 2.4042314473473312E-4 QSAR 0.0012822567719185766 Quantum Mechanics 0.5773361115563391 Reflex 0.05457605385478442 Reflex Plus 7.212694342041994E-4 Semi-empirical 0.008254527969225838 Sorption 0.054095207565314954 Synthia 0.0014425388684083987 TURBOMOLE 5.609873377143773E-4 VAMP 0.0016829620131431319 Visualization 0.8742586953037346 X-Cell 0.0011219746754287546 ZDOCK 0.030133034140086553

Year

2020 0.020052539404553416 2021 0.13047285464098074 2022 0.2598073555166375 2023 0.4424693520140105 2024 0.9056042031523642 2025 1.0 2026 0.3722416812609457 2027 0.0

Keywords

target 1.0 potential 0.26417275973473897 docking 0.2155755823839483 visualization 0.21095051861928243 analysis 0.18068355721816018 between 0.14932834551946947 novel 0.09964291787111036 energy 0.08121067845604489 binding 0.06896786260839993 cell 0.05767726577112736 activity 0.05053562319333447 promising 0.04472028566570311 interaction 0.037374596157116136 synthesized 0.02775038258799524 experimental 0.026730147934024825 stability 0.026356061894235675 protein 0.019078388029246728 performance 0.01656180921611971 mechanism 0.016255738819928582 effective 0.015813637136541405 development 0.015167488522360143 synthesis 0.011256589015473559 including 0.00846794762795443 chemical 0.0018364223771467438 design 0.0
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