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Application

Discovery Studio 1.0 Materials Studio 0.6802941176470588 Solvation Chemistry 0.0

Modules

Adsorption Locator 0.10141394441735739 Amorphous Cell 0.11555338859093126 Blends 9.751340809361287E-4 CASTEP 0.31935641150658217 CDOCKER 0.24085811799122378 CHARMm 0.2979034617259873 COMPASS 0.28278888347147735 COMPASS III 0.03461725987323257 COSMObase 0.0 COSMOconf 4.8756704046806434E-4 COSMOmic 0.0 COSMOperm 4.8756704046806434E-4 COSMOquick 0.0 COSMOtherm 0.026328620185275476 Catalyst 0.295465626523647 Classical Simulations 0.8615309605070697 Conformers 4.8756704046806434E-4 Crystallization 0.11555338859093126 DFTB Plus 0.0048756704046806435 DMol3 0.14870794734275963 DPD 0.0019502681618722574 Discover 0.0039005363237445147 Forcite 0.37396392003900536 GULP 0.01462701121404193 LUDI 0.005363237445148708 LibDock 0.07411019015114578 LigandFit 0.01121404193076548 MCSS 0.0014627011214041932 MODELER 0.14675767918088736 MesoDyn 0.0019502681618722574 Mesocite 0.0024378352023403218 Mesoscale 0.006338371526084837 Morphology 0.015114578254509995 Polymorph 9.751340809361287E-4 QMERA 4.8756704046806434E-4 QSAR 0.0014627011214041932 Quantum Mechanics 0.462213554363725 Reflex 0.098488542174549 Reflex Plus 0.0029254022428083864 Semi-empirical 0.008288639687957094 Sorption 0.040955631399317405 Synthia 0.0024378352023403218 TURBOMOLE 0.0 VAMP 0.0019502681618722574 Visualization 1.0 X-Cell 0.0024378352023403218 ZDOCK 0.005850804485616773

Year

2015 0.03822098679638638 2016 0.06740792216817235 2017 0.1014593467685893 2018 0.12230715774843641 2019 0.14662960389159138 2020 0.14454482279360667 2021 0.2925642807505212 2022 0.42599027102154274 2023 0.49131341209173035 2024 0.8742182070882557 2025 1.0 2026 0.3690062543432939 2027 0.0

Keywords

synthesized 1.0 target 0.9618593563766389 synthesis 0.36591179976162097 docking 0.333134684147795 novel 0.2759237187127533 potential 0.2536750099324593 visualization 0.23937226857369884 compound 0.19586809694080254 analysis 0.14243146603098927 activity 0.1394517282479142 binding 0.09336511720301947 promising 0.09316646801748113 designed 0.09217322208978942 design 0.08661104489471594 potent 0.08541914978148589 inhibition 0.08025427095748908 between 0.07767183154549066 vitro 0.06555423122765197 experimental 0.03257846642828764 active 0.018871672626142234 cell 0.018077075883988877 effective 0.010131108462455305 development 0.00834326579261025 drug 0.004370282081843465 energy 0.0
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