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Application

Discovery Studio 0.8472222222222222 Materials Studio 1.0 Solvation Chemistry 0.0

Modules

Adsorption Locator 0.068394128113879 Amorphous Cell 0.28825622775800713 Blends 0.002335409252669039 CASTEP 0.38923487544483987 CDOCKER 0.1514679715302491 CHARMm 0.23454181494661921 COMPASS 0.37221975088967973 COMPASS III 0.08896797153024912 COSMObase 0.00400355871886121 COSMOconf 0.004225978647686833 COSMOmic 2.2241992882562276E-4 COSMOperm 0.001445729537366548 COSMOplex 2.2241992882562276E-4 COSMOquick 0.0016681494661921709 COSMOtherm 0.06561387900355872 Catalyst 0.09686387900355872 Classical Simulations 1.0 Conformers 8.896797153024911E-4 Crystallization 0.076067615658363 DFTB Plus 0.005004448398576513 DMol3 0.17960409252669038 DPD 0.0026690391459074734 Discover 0.0038923487544483986 Forcite 0.551935053380783 GULP 0.025244661921708184 Kinetix 2.2241992882562276E-4 LUDI 0.0038923487544483986 LibDock 0.06383451957295373 LigandFit 0.004559608540925267 MCSS 6.672597864768683E-4 MODELER 0.1875 MesoDyn 0.0015569395017793594 Mesocite 0.0038923487544483986 Mesoscale 0.007339857651245551 Modules 0.0 Morphology 0.017793594306049824 ONETEP 8.896797153024911E-4 Polymorph 0.0018905693950177936 QMERA 2.2241992882562276E-4 QSAR 8.896797153024911E-4 Quantum Mechanics 0.5568282918149466 Reflex 0.0557161921708185 Reflex Plus 0.0010008896797153025 Semi-empirical 0.006895017793594306 Sorption 0.057273131672597864 Synthia 0.001445729537366548 TURBOMOLE 4.4483985765124553E-4 VAMP 0.001445729537366548 Visualization 0.7211966192170819 X-Cell 0.001445729537366548 ZDOCK 0.02568950177935943

Year

2022 0.06251808972503618 2023 0.2010612638687892 2024 0.6415822479498312 2025 1.0 2026 0.4101302460202605 2027 0.0

Keywords

target 1.0 potential 0.2730150625478683 docking 0.1916262445749298 analysis 0.18856267551697728 visualization 0.1714066887924432 between 0.157161092672964 novel 0.09675772274700026 energy 0.09573653306101608 cell 0.06571355629308144 promising 0.05943323972427878 binding 0.05785039571100332 performance 0.04110288486086291 activity 0.03982639775338269 stability 0.037222364054123054 experimental 0.03211641562420219 interaction 0.029512381924942557 synthesized 0.02552974214960429 effective 0.020117436813888178 including 0.018381414347715088 mechanism 0.01797293847332142 development 0.016696451365841206 synthesis 0.0051059484299208575 protein 0.004595353586928772 design 0.0011233086545825888 enhanced 0.0
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