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Application

Discovery Studio 1.0 Materials Studio 0.9893353174603174 Solvation Chemistry 0.0

Modules

Adsorption Locator 0.06602860522636843 Amorphous Cell 0.2794924185396279 Blends 0.0021507688998817077 CASTEP 0.37272825034949997 CDOCKER 0.1707710506506076 CHARMm 0.26250134423056243 COMPASS 0.35670502204538124 COMPASS III 0.08484783310033336 COSMObase 0.0034412302398107325 COSMOconf 0.00419399935476933 COSMOmic 2.1507688998817078E-4 COSMOperm 0.0012904613399290247 COSMOplex 1.0753844499408539E-4 COSMOquick 0.0012904613399290247 COSMOtherm 0.0618346058715991 Cantera 0.0 Catalyst 0.11710936659855899 Classical Simulations 1.0 Conformers 8.603075599526831E-4 Crystallization 0.0728035272609958 DFTB Plus 0.005054306914722013 DMol3 0.1693730508656845 DPD 0.0026884611248521348 Discover 0.0035487686848048178 Forcite 0.5358640714055275 GULP 0.0227981503387461 Kinetix 2.1507688998817078E-4 LUDI 0.004946768469727927 LibDock 0.07065275836111409 LigandFit 0.005914614474674697 MCSS 8.603075599526831E-4 MODELER 0.19948381546402838 MesoDyn 0.0011829228949349392 Mesocite 0.003333691794816647 Mesoscale 0.006667383589633294 Modules 0.0 Morphology 0.017313689644047746 ONETEP 9.678460049467684E-4 Polymorph 0.0016130766749112807 QMERA 2.1507688998817078E-4 QSAR 8.603075599526831E-4 Quantum Mechanics 0.5321002258307345 Reflex 0.05323153027207227 Reflex Plus 9.678460049467684E-4 Semi-empirical 0.006774922034627379 Sorption 0.05570491450693623 Synthia 0.0011829228949349392 TURBOMOLE 5.376922249704269E-4 VAMP 0.0012904613399290247 Visualization 0.816109259060114 X-Cell 0.0012904613399290247 ZDOCK 0.028605226368426714

Year

2021 0.0011350737797956867 2022 0.1373439273552781 2023 0.25813469542186906 2024 0.6397086643965191 2025 1.0 2026 0.402099886492622 2027 0.0

Keywords

target 1.0 potential 0.2846310601393299 docking 0.22311738780152598 visualization 0.20278659779157385 analysis 0.19762096583100328 between 0.1536420074877968 novel 0.10520828396758447 energy 0.08601488081133596 binding 0.07686839486280271 cell 0.0659210463959054 promising 0.06250888583479455 activity 0.05587412918819013 stability 0.039571584285104974 interaction 0.036633334913037295 performance 0.030946400644519218 synthesized 0.0308990095256149 experimental 0.027818586796834275 effective 0.024074688403393205 mechanism 0.022463390360646415 development 0.02009383441543055 including 0.019951661058717596 protein 0.019904269939813278 synthesis 0.013648642244443392 design 0.004170418463579925 chemical 0.0
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