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Application

Discovery Studio 1.0 Materials Studio 0.9534524218481621 Solvation Chemistry 0.0

Modules

Adsorption Locator 0.057351638618246235 Amorphous Cell 0.27900797165633306 Blends 0.001550044286979628 CASTEP 0.3345881310894597 CDOCKER 0.17493356953055803 CHARMm 0.2688219663418955 COMPASS 0.3454384410983171 COMPASS III 0.10407440212577503 COSMObase 0.003985828166519044 COSMOconf 0.005535872453498672 COSMOmic 2.2143489813994686E-4 COSMOperm 0.001328609388839681 COSMOplex 2.2143489813994686E-4 COSMOquick 8.857395925597874E-4 COSMOtherm 0.06443755535872453 Catalyst 0.09676705048715678 Classical Simulations 1.0 Conformers 4.428697962798937E-4 Crystallization 0.07263064658990256 DFTB Plus 0.005757307351638618 DMol3 0.15234720992028344 DPD 0.002878653675819309 Discover 0.00354295837023915 Forcite 0.5298937112488928 GULP 0.018821966341895483 Kinetix 2.2143489813994686E-4 LUDI 0.002435783879539415 LibDock 0.07174490699734277 LigandFit 0.0044286979627989375 MODELER 0.24468556244464126 MesoDyn 2.2143489813994686E-4 Mesocite 0.002657218777679362 Mesoscale 0.005535872453498672 Modules 0.0 Morphology 0.017936226749335694 ONETEP 0.0011071744906997344 Polymorph 0.0022143489813994687 QMERA 0.0 QSAR 4.428697962798937E-4 Quantum Mechanics 0.4782993799822852 Reflex 0.05137289636846767 Reflex Plus 0.001550044286979628 Semi-empirical 0.006864481842338352 Sorption 0.061780336581045175 Synthia 0.001992914083259522 TURBOMOLE 2.2143489813994686E-4 VAMP 6.643046944198405E-4 Visualization 0.774800708591674 X-Cell 8.857395925597874E-4 ZDOCK 0.028565101860053146

Year

2023 0.09009441510641703 2024 0.3763802208353337 2025 1.0 2026 0.4911185789726356 2027 0.0

Keywords

target 1.0 potential 0.30012200081333873 docking 0.22529483529890199 analysis 0.20892639284261896 visualization 0.18615290768605125 between 0.1439609597397316 novel 0.09577063847092314 energy 0.07797885319235462 promising 0.07614884099227329 binding 0.07228548190321268 cell 0.06110207401382676 activity 0.056222041480276534 stability 0.03639690931272875 performance 0.029991866612444084 synthesized 0.023586823912159414 including 0.021553477023180154 interaction 0.01911346075640504 development 0.018300122000813338 effective 0.016368442456283043 experimental 0.016063440422936153 mechanism 0.015250101667344449 protein 0.0071167141114274095 synthesis 0.0021350142334282227 enhanced 0.0017283448556323709 strong 0.0
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