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Application

Discovery Studio 0.4920259893679858 Materials Studio 1.0 Solvation Chemistry 0.0

Modules

Adsorption Locator 0.07547781017168773 Amorphous Cell 0.3087139617751863 Blends 0.0029154518950437317 CASTEP 0.5652737285390347 CDOCKER 0.10463232912212504 CHARMm 0.16715257531584063 COMPASS 0.4609653385163589 COMPASS III 0.050858438613540655 COSMObase 9.718172983479105E-4 COSMOconf 6.478781988986071E-4 COSMOmic 3.2393909944930353E-4 COSMOperm 0.0016196954972465176 COSMOplex 3.2393909944930353E-4 COSMOquick 0.001943634596695821 COSMOtherm 0.0738581146744412 Cantera 0.0 Catalyst 0.06770327178490444 Classical Simulations 1.0 Conformers 0.001943634596695821 Crystallization 0.09329446064139942 DFTB Plus 0.009394233884029803 DMol3 0.26951733074182055 DPD 0.0051830255911888565 Discover 0.008098477486232589 Forcite 0.5905409782960803 GULP 0.04016844833171364 LUDI 9.718172983479105E-4 LibDock 0.043407839326206676 LigandFit 0.0029154518950437317 MCSS 0.0 MODELER 0.16067379332685455 MesoDyn 0.0029154518950437317 Mesocite 0.00647878198898607 Mesoscale 0.012633624878522837 Morphology 0.019760285066407514 ONETEP 0.0016196954972465176 Polymorph 0.0022675736961451248 QMERA 0.0 QSAR 0.0025915127955944283 Quantum Mechanics 0.8179462261094914 Reflex 0.07126660187884677 Semi-empirical 0.012309685779073534 Sorption 0.05409782960803369 Synthia 0.001943634596695821 TURBOMOLE 6.478781988986071E-4 VAMP 0.0022675736961451248 Visualization 0.5458373825720765 X-Cell 6.478781988986071E-4 ZDOCK 0.01652089407191448

Year

2024 0.0

Keywords

target 1.0 potential 0.21557058569578358 between 0.18405525974960427 analysis 0.1470715210821701 energy 0.12692473737228377 docking 0.09512160023024896 visualization 0.08605554756080011 novel 0.07526262771621817 cell 0.05612318319182616 experimental 0.05166210965606562 interaction 0.036983738667434166 performance 0.031227514750323787 stability 0.030220175564829473 promising 0.024320046049791336 chemical 0.01870772773060872 effective 0.018276010936825442 surface 0.01626133256583681 mechanism 0.015685710174125775 synthesized 0.010936825442509714 binding 0.006475751906749172 activity 0.005468412721254857 higher 0.00230248956684415 adsorption 2.878111958555188E-4 development 1.439055979277594E-4 well 0.0
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