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Application

Discovery Studio 1.0 Materials Studio 0.9508213552361396 Solvation Chemistry 0.0

Modules

Adsorption Locator 0.06747317635198387 Amorphous Cell 0.27370922445452583 Blends 0.0028803917332757257 CASTEP 0.4146323900050407 CDOCKER 0.18333693382299993 CHARMm 0.26427594152804784 COMPASS 0.3733707784258659 COMPASS III 0.07164974436523368 COSMObase 0.002736372146611939 COSMOconf 0.003168430906603298 COSMOmic 2.1602937999567941E-4 COSMOperm 0.0012241664866421834 COSMOplex 3.600489666594657E-4 COSMOquick 0.001512205659969756 COSMOtherm 0.06286454957874271 Cantera 7.200979333189313E-5 Catalyst 0.12097645279758047 Classical Simulations 1.0 Conformers 0.0011521566933102901 Crystallization 0.0755382732051559 DFTB Plus 0.005832793259883344 DMol3 0.19024987398286167 DPD 0.003024411319939512 Discover 0.005040685533232519 Forcite 0.5285518830560957 GULP 0.026571613739468567 Kinetix 2.1602937999567941E-4 LUDI 0.0061208324332109165 LibDock 0.07301793043853964 LigandFit 0.008569165406495284 MCSS 0.001584215453301649 MODELER 0.19889104918268885 MesoDyn 0.0016562252466335422 Mesocite 0.004104558219917909 Mesoscale 0.007633038093180672 Modules 0.0 Morphology 0.017786418952977605 ONETEP 0.0012961762799740765 Polymorph 0.0018722546266292217 QMERA 2.1602937999567941E-4 QSAR 0.0014401958666378628 Quantum Mechanics 0.5920645207748254 Reflex 0.0555915604522215 Reflex Plus 6.480881399870382E-4 Semi-empirical 0.007921077266508245 Sorption 0.053503276445596604 Synthia 0.0013681860733059696 TURBOMOLE 5.04068553323252E-4 VAMP 0.0017282350399654353 Visualization 0.9081155037085044 X-Cell 0.0011521566933102901 ZDOCK 0.03168430906603298

Year

2020 0.07687748708830751 2021 0.2555245110490221 2022 0.29421725510117686 2023 0.48395563457793583 2024 1.0 2025 0.9683346033358733 2026 0.35991871983743967 2027 0.0

Keywords

target 1.0 potential 0.2551355547593455 visualization 0.21688761495282455 docking 0.2160217365340977 analysis 0.17410127791711452 between 0.15000597157530157 novel 0.09966559178311238 energy 0.07852621521557387 binding 0.06941956288068793 cell 0.05517735578645647 activity 0.05302758867789323 promising 0.03989012301445121 interaction 0.03944225486683387 synthesized 0.027081093992595246 experimental 0.02612564194434492 stability 0.021557386838648034 protein 0.021258808073569807 mechanism 0.01621282694374776 effective 0.014749790994864445 development 0.014451212229786218 synthesis 0.011913292726621283 performance 0.00907679445837812 including 0.004299534217126478 chemical 0.0024483458736414667 design 0.0
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